AC1MISDA structure

AC1MISDA

methyl 2'-amino-5-bromo-2,5'-dioxospiro[1H-indole-3,4'-7,8-dihydro-6H-chromene]-3'-carboxylate

Also Known As: ChemDiv1_002412|Oprea1_075085|Oprea1_556844|HMS593N14|BAS 01108273|SR-01000360332-1|A0907/0042606|methyl 2-amino-5'-bromo-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carboxylate|methyl 2'-amino-5-bromo-2,5'-dioxospiro[1H-indole-3,4'-7,8-dihydro-6H-chromene]-3'-carboxylate|methyl 2-amino-15-bromo-5,12-dioxospiro[4H-6,7,8-trihydrochromene-4,3'-indolin e]-3-carboxylate|methyl 2-amino-5'-bromo-2',5-dioxo-5,6,7,8-tetrahydrospiro[chromene-4,3'-indoline]-3-carboxylate

CAS: 313381-98-5
Molecular Formula C18H15BrN2O5
Molecular Weight 418.01642 g/mol
LogP 2.0196
Topological Polar Surface Area 107.72 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 1
Exact Mass 418.01642
Monoisotopic Mass 418.01642
Heavy Atoms 26
Complexity 948.8999

Chemical Identifiers

CAS Number 313381-98-5
SMILES COC(=O)C1=C(OC2=C(C13C4=C(C=CC(=C4)Br)NC3=O)C(=O)CCC2)N

Product Overview

AC1MISDA (CAS 313381-98-5), with molecular formula C18H15BrN2O5 and molecular weight 418.01642 g/mol. IUPAC: methyl 2'-amino-5-bromo-2,5'-dioxospiro[1H-indole-3,4'-7,8-dihydro-6H-chromene]-3'-carboxylate.

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