AC1L70RW

triethyl 1-methyl-4-oxo-6,7-dihydro-5H-pyrrolo[2,3-b]azepine-3,5,8-tricarboxylate

Also Known As: Triethyl 1-methyl-4-oxo-4,5,6,7-tetrahydropyrrolo(2,3-b)azepine-3,5,8(1H)-tricarboxylate|triethyl 1-methyl-4-oxo-6,7-dihydro-5H-pyrrolo[2,3-b]azepine|triethyl 1-methyl-4-oxo-6,7-dihydro-5H-pyrrolo[2,3-b]azepine-3,5,8-tricarboxylate|Triethyl 1-methyl-4-oxo-4,5,6,7-tetrahydropyrrolo[2,3-b]azepine-3,5,8(1H)-tricarboxylate|3,5,8-Triethyl 4,5,6,7-tetrahydro-1-methyl-4-oxopyrrolo[2,3-b]azepine-3,5,8(1H)-tricarboxylate|Pyrrolo[2,3-b]azepine-3,5,8(1H)-tricarboxylic acid, 4,5,6,7-tetrahydro-1-methyl-4-oxo-, 3,5,8-triethyl ester

Molecular Formula	C18H24N2O7
Molecular Weight	380.15836 g/mol
LogP	1.7
Topological Polar Surface Area	104.0 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	380.15836
Monoisotopic Mass	380.15836
Heavy Atoms	27
Complexity	594.0

Chemical Identifiers

CAS Number	77557-55-2
SMILES	CCOC(=O)C1CCN(C2=C(C1=O)C(=CN2C)C(=O)OCC)C(=O)OCC
InChIKey	XGLGRPXTVFKPSY-UHFFFAOYSA-N