(2S)-3-[4-(2-cyanophenyl)phenyl]-2-(phenylcarbamoylamino)propanoic acid

Systemtic Name: (2S)-3-[4-(2-cyanophenyl)phenyl]-2-(phenylcarbamoylamino)propanoic acid Openeye Name: (2S)-3-[4-(2-cyanophenyl)phenyl]-2-(phenylcarbamoylamino)propanoic acid CAS Name: (2S)-2-[[anilino(oxo)methyl]amino]-3-[4-(2-cyanophenyl)phenyl]propanoic acid IUPAC Name: (2S)-3-[4-(2-cyanophenyl)phenyl]-2-(phenylcarbamoylamino)propanoic acid Traditional Name: (2S)-3-[4-(2-cyanophenyl)phenyl]-2-(phenylcarbamoylamino)propionic acid Formula: C23H19N3O3 MolecularWeight: 385.41526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC(CC2=CC=C(C=C2)C3=CC=CC=C3C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)N[C@@H](CC2=CC=C(C=C2)C3=CC=CC=C3C#N)C(=O)O

InChI

InChI=1S/C23H19N3O3/c24-15-18-6-4-5-9-20(18)17-12-10-16(11-13-17)14-21(22(27)28)26-23(29)25-19-7-2-1-3-8-19/h1-13,21H,14H2,(H,27,28)(H2,25,26,29)/t21-/m0/s1