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

Systemtic Name: 2-[3-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]propanoic acid hydrochloride Openeye Name: 2-[3-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]propanoic acid hydrochloride CAS Name: 2-[3-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]propanoic acid hydrochloride IUPAC Name: 2-[3-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]propanoic acid hydrochloride Traditional Name: 2-[3-[(1-carbethoxy-3-phenyl-propyl)amino]-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl]propionic acid hydrochloride Formula: C25H31ClN2O5 MolecularWeight: 474.97704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC2CCC3=CC=CC=C3N(C2=O)C(C)C(=O)O.Cl

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC2CCC3=CC=CC=C3N(C2=O)C(C)C(=O)O.Cl

InChI

InChI=1S/C25H30N2O5.ClH/c1-3-32-25(31)21(15-13-18-9-5-4-6-10-18)26-20-16-14-19-11-7-8-12-22(19)27(23(20)28)17(2)24(29)30;/h4-12,17,20-21,26H,3,13-16H2,1-2H3,(H,29,30);1H