ethyl 4-[(1-butyl-5,5-dimethyl-2-oxidanylidene-3,4-dihydro-1-benzazepin-7-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(1-butyl-5,5-dimethyl-2-oxidanylidene-3,4-dihydro-1-benzazepin-7-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(1-butyl-5,5-dimethyl-2-oxo-3,4-dihydro-1-benzazepine-7-carbonyl)amino]benzoate CAS Name: 4-[[(1-butyl-5,5-dimethyl-2-oxo-3,4-dihydro-1-benzazepin-7-yl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1-butyl-5,5-dimethyl-2-oxo-3,4-dihydro-1-benzazepine-7-carbonyl)amino]benzoate Traditional Name: 4-[(1-butyl-2-keto-5,5-dimethyl-3,4-dihydro-1-benzazepine-7-carbonyl)amino]benzoic acid ethyl ester Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)CCC(C2=C1C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)OCC)(C)C

Isomeric SMILES

CCCCN1C(=O)CCC(C2=C1C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)OCC)(C)C

InChI

InChI=1S/C26H32N2O4/c1-5-7-16-28-22-13-10-19(17-21(22)26(3,4)15-14-23(28)29)24(30)27-20-11-8-18(9-12-20)25(31)32-6-2/h8-13,17H,5-7,14-16H2,1-4H3,(H,27,30)