ethyl 2-azanyl-3-(phenylcarbonyl)-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carboxylate

Systemtic Name: ethyl 2-azanyl-3-(phenylcarbonyl)-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carboxylate Openeye Name: ethyl 2-amino-3-benzoyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carboxylate CAS Name: 2-amino-3-benzoyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-3-benzoyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepine-1-carboxylate Traditional Name: 2-amino-3-benzoyl-6,7,8,9-tetrahydro-5H-pyrrol[1,2-a]azepine-1-carboxylic acid ethyl ester Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCCCCN2C(=C1N)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C2CCCCCN2C(=C1N)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2O3/c1-2-24-19(23)15-14-11-7-4-8-12-21(14)17(16(15)20)18(22)13-9-5-3-6-10-13/h3,5-6,9-10H,2,4,7-8,11-12,20H2,1H3