ethyl 5-(3-methylphenyl)carbonyl-6H-benzo[b][1,4]benzoxazepine-3-carboxylate

Systemtic Name: ethyl 5-(3-methylphenyl)carbonyl-6H-benzo[b][1,4]benzoxazepine-3-carboxylate Openeye Name: ethyl 5-(3-methylbenzoyl)-6H-benzo[b][1,4]benzoxazepine-3-carboxylate CAS Name: 5-[(3-methylphenyl)-oxomethyl]-6H-benzo[b][1,4]benzoxazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-methylbenzoyl)-6H-benzo[b][1,4]benzoxazepine-3-carboxylate Traditional Name: 5-m-toluoyl-6H-benzo[b][1,4]benzoxazepine-3-carboxylic acid ethyl ester Formula: C24H21NO4 MolecularWeight: 387.42784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)OC3=CC=CC=C3CN2C(=O)C4=CC(=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)OC3=CC=CC=C3CN2C(=O)C4=CC(=CC=C4)C

InChI

InChI=1S/C24H21NO4/c1-3-28-24(27)18-11-12-22-20(14-18)25(15-19-8-4-5-10-21(19)29-22)23(26)17-9-6-7-16(2)13-17/h4-14H,3,15H2,1-2H3