methyl 4-[(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)carbamoyl]benzoate

Systemtic Name: methyl 4-[(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)carbamoyl]benzoate Openeye Name: methyl 4-[(3,5-dimethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)carbamoyl]benzoate CAS Name: 4-[[(3,5-dimethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3,5-dimethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)carbamoyl]benzoate Traditional Name: 4-[(6-keto-3,5-dimethyl-benzo[b][1,4]benzoxazepin-8-yl)carbamoyl]benzoic acid methyl ester Formula: C24H20N2O5 MolecularWeight: 416.426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)C4=CC=C(C=C4)C(=O)OC)C(=O)N2C

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)C4=CC=C(C=C4)C(=O)OC)C(=O)N2C

InChI

InChI=1S/C24H20N2O5/c1-14-4-10-21-19(12-14)26(2)23(28)18-13-17(9-11-20(18)31-21)25-22(27)15-5-7-16(8-6-15)24(29)30-3/h4-13H,1-3H3,(H,25,27)