[2-oxidanylidene-2-[(2-phenylphenyl)amino]ethyl] 6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2-phenylphenyl)amino]ethyl] 6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate Openeye Name: [2-oxo-2-(2-phenylanilino)ethyl] 6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate CAS Name: 6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid [2-oxo-2-(2-phenylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylanilino)ethyl] 6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylate Traditional Name: 6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid [2-keto-2-(2-phenylanilino)ethyl] ester Formula: C24H20ClNO5 MolecularWeight: 437.8723

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)OCC(=O)NC3=CC=CC=C3C4=CC=CC=C4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)OCC(=O)NC3=CC=CC=C3C4=CC=CC=C4)Cl)OC1

InChI

InChI=1S/C24H20ClNO5/c25-19-13-17(14-21-23(19)30-12-6-11-29-21)24(28)31-15-22(27)26-20-10-5-4-9-18(20)16-7-2-1-3-8-16/h1-5,7-10,13-14H,6,11-12,15H2,(H,26,27)