RefChem:1068773 structure

RefChem:1068773

ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate

Also Known As: Oprea1_017993|Oprea1_851304|CBDivE_011639|IFLab1_004002|ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|BAS 01039413|5-22-06-00426 (Beilstein Handbook Reference)|J2.143.453A|AG-690/36631024|ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate|SR-01000396842-1|F0896-0078|1,4,5,6,7,8-Hexahydro-5-oxo-4-phenyl-2,7,7-trimethyl-3-quinolinecarboxylic acid ethyl ester|3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-4-phenyl-, ethyl ester|3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-5-oxo-4-phenyl-2,7,7-trimethyl-, ethyl ester|ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate|ethyl 1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-4-phenyl-5-oxoquinoline-3-carboxylate|ethyl-1,4,5,6,7,8-hexahydro-2,7,7-trimethyl-5-oxo-4-phenylquinoline-3-carboxylate|1,4,5,6,7,8-Hexahydro-2,7,7-trimethyl-4-phenyl-5-oxo-3-quinolinecarboxylic acid ethyl ester|1,4,5,6,7,8-Hexahydro-2,7,7-trimethyl-4-phenyl-5-oxoquinoline-3-carboxylic acid ethyl ester|1,4,5,6,7,8-Hexahydro-2,7,7-trimethyl-5-oxo-4-phenylquinoline-3-carboxylic acid ethyl ester|2,7,7-Trimethyl-4-phenyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylic acid ethyl ester|4-Phenyl-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-7,7-dimethylquinoline-3-carboxylic acid ethyl ester|4-Phenyl-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylic acid ethyl ester|4-Phenyl-5-oxo-2,7,7-trimethyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylic acid ethyl ester|7,7-Dimethyl-4-phenyl-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylic acid ethyl ester

CAS: 13337-64-9
Molecular Formula C21H25NO3
Molecular Weight 339.18344 g/mol
LogP 3.6
Topological Polar Surface Area 55.4 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 339.18344
Monoisotopic Mass 339.18344
Heavy Atoms 25
Complexity 636.0

Chemical Identifiers

CAS Number 13337-64-9
SMILES CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3)C(=O)CC(C2)(C)C)C
InChIKey BHUYANTVBSTZDM-UHFFFAOYSA-N

Product Overview

RefChem:1068773 (CAS 13337-64-9), with molecular formula C21H25NO3 and molecular weight 339.18344 g/mol. IUPAC: ethyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,6,8-tetrahydroquinoline-3-carboxylate.

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