(3R)-4-oxidanylidene-4-phenylazanyl-3-(phenylmethyl)butanoate

Systemtic Name: (3R)-4-oxidanylidene-4-phenylazanyl-3-(phenylmethyl)butanoate Openeye Name: (3R)-4-anilino-3-benzyl-4-oxo-butanoate CAS Name: (3R)-4-anilino-4-oxo-3-(phenylmethyl)butanoate IUPAC Name: (3R)-4-anilino-3-benzyl-4-oxobutanoate Traditional Name: (3R)-4-anilino-3-benzyl-4-keto-butyrate Formula: C17H16NO3- MolecularWeight: 282.31384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(=O)[O-])C(=O)NC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO3/c19-16(20)12-14(11-13-7-3-1-4-8-13)17(21)18-15-9-5-2-6-10-15/h1-10,14H,11-12H2,(H,18,21)(H,19,20)/p-1/t14-/m1/s1