tert-butyl 2-[3-[(4-chlorophenyl)carbonylamino]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[3-[(4-chlorophenyl)carbonylamino]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoate Openeye Name: tert-butyl 2-[3-[(4-chlorobenzoyl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetate CAS Name: 2-[3-[[(4-chlorophenyl)-oxomethyl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-[(4-chlorobenzoyl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetate Traditional Name: 2-[3-[(4-chlorobenzoyl)amino]-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid tert-butyl ester Formula: C23H25ClN2O4 MolecularWeight: 428.9086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C2=CC=CC=C2CCC(C1=O)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CN1C2=CC=CC=C2CCC(C1=O)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H25ClN2O4/c1-23(2,3)30-20(27)14-26-19-7-5-4-6-15(19)10-13-18(22(26)29)25-21(28)16-8-11-17(24)12-9-16/h4-9,11-12,18H,10,13-14H2,1-3H3,(H,25,28)