2-[[cyano(phenyl)methyl]amino]-3-phenyl-propanoic acid hydrochloride

Systemtic Name: 2-[[cyano(phenyl)methyl]amino]-3-phenyl-propanoic acid hydrochloride Openeye Name: 2-[[cyano(phenyl)methyl]amino]-3-phenyl-propanoic acid hydrochloride CAS Name: 2-[[cyano(phenyl)methyl]amino]-3-phenylpropanoic acid hydrochloride IUPAC Name: 2-[[cyano(phenyl)methyl]amino]-3-phenylpropanoic acid hydrochloride Traditional Name: 2-[[cyano(phenyl)methyl]amino]-3-phenyl-propionic acid hydrochloride Formula: C17H17ClN2O2 MolecularWeight: 316.78208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(C#N)C2=CC=CC=C2.Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(C#N)C2=CC=CC=C2.Cl

InChI

InChI=1S/C17H16N2O2.ClH/c18-12-16(14-9-5-2-6-10-14)19-15(17(20)21)11-13-7-3-1-4-8-13;/h1-10,15-16,19H,11H2,(H,20,21);1H