[2-oxidanylidene-2-[(2-phenoxyphenyl)amino]ethyl] 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2-phenoxyphenyl)amino]ethyl] 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate Openeye Name: [2-oxo-2-(2-phenoxyanilino)ethyl] 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-carboxylic acid [2-oxo-2-(2-phenoxyanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2-phenoxyanilino)ethyl] 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-carboxylic acid [2-keto-2-(2-phenoxyanilino)ethyl] ester Formula: C24H21NO6 MolecularWeight: 419.42664

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=CC=C3OC4=CC=CC=C4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=CC=C3OC4=CC=CC=C4)OC1

InChI

InChI=1S/C24H21NO6/c26-23(25-19-9-4-5-10-20(19)31-18-7-2-1-3-8-18)16-30-24(27)17-11-12-21-22(15-17)29-14-6-13-28-21/h1-5,7-12,15H,6,13-14,16H2,(H,25,26)