2-[2-oxidanylidene-3-[(1-oxidanylidene-4-phenyl-1-phenylmethoxy-butan-2-yl)amino]-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid hydrochloride

Systemtic Name: 2-[2-oxidanylidene-3-[(1-oxidanylidene-4-phenyl-1-phenylmethoxy-butan-2-yl)amino]-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid hydrochloride Openeye Name: 2-[3-[(1-benzyloxycarbonyl-3-phenyl-propyl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid hydrochloride CAS Name: 2-[2-oxo-3-[(1-oxo-4-phenyl-1-phenylmethoxybutan-2-yl)amino]-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid hydrochloride IUPAC Name: 2-[2-oxo-3-[(1-oxo-4-phenyl-1-phenylmethoxybutan-2-yl)amino]-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid hydrochloride Traditional Name: 2-[3-[(1-carbobenzoxy-3-phenyl-propyl)amino]-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid hydrochloride Formula: C29H31ClN2O5 MolecularWeight: 523.01984

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C(=O)C1NC(CCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4)CC(=O)O.Cl

Isomeric SMILES

C1CC2=CC=CC=C2N(C(=O)C1NC(CCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4)CC(=O)O.Cl

InChI

InChI=1S/C29H30N2O5.ClH/c32-27(33)19-31-26-14-8-7-13-23(26)16-18-24(28(31)34)30-25(17-15-21-9-3-1-4-10-21)29(35)36-20-22-11-5-2-6-12-22;/h1-14,24-25,30H,15-20H2,(H,32,33);1H