[2-(4-acetamidophenyl)-2-oxidanylidene-ethyl] 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate

Systemtic Name: [2-(4-acetamidophenyl)-2-oxidanylidene-ethyl] 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate Openeye Name: [2-(4-acetamidophenyl)-2-oxo-ethyl] 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetate CAS Name: 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetic acid [2-(4-acetamidophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamidophenyl)-2-oxoethyl] 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetate Traditional Name: 2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetic acid [2-(4-acetamidophenyl)-2-keto-ethyl] ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CN2C(=O)CCOC3=CC=CC=C32

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CN2C(=O)CCOC3=CC=CC=C32

InChI

InChI=1S/C21H20N2O6/c1-14(24)22-16-8-6-15(7-9-16)18(25)13-29-21(27)12-23-17-4-2-3-5-19(17)28-11-10-20(23)26/h2-9H,10-13H2,1H3,(H,22,24)