(3R)-5-[[4-(cyanomethyl)phenyl]amino]-5-oxidanylidene-3-phenyl-pentanoic acid

Systemtic Name: (3R)-5-[[4-(cyanomethyl)phenyl]amino]-5-oxidanylidene-3-phenyl-pentanoic acid Openeye Name: (3R)-5-[4-(cyanomethyl)anilino]-5-oxo-3-phenyl-pentanoic acid CAS Name: (3R)-5-[4-(cyanomethyl)anilino]-5-oxo-3-phenylpentanoic acid IUPAC Name: (3R)-5-[4-(cyanomethyl)anilino]-5-oxo-3-phenylpentanoic acid Traditional Name: (3R)-5-[4-(cyanomethyl)anilino]-5-keto-3-phenyl-valeric acid Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)NC2=CC=C(C=C2)CC#N)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CC(=O)NC2=CC=C(C=C2)CC#N)CC(=O)O

InChI

InChI=1S/C19H18N2O3/c20-11-10-14-6-8-17(9-7-14)21-18(22)12-16(13-19(23)24)15-4-2-1-3-5-15/h1-9,16H,10,12-13H2,(H,21,22)(H,23,24)/t16-/m1/s1