(2R,3S)-2-benzamido-3-(4-chlorophenyl)-4-cyano-pent-4-enoic acid

Systemtic Name: (2R,3S)-2-benzamido-3-(4-chlorophenyl)-4-cyano-pent-4-enoic acid Openeye Name: (2R,3S)-2-benzamido-3-(4-chlorophenyl)-4-cyano-pent-4-enoic acid CAS Name: (2R,3S)-2-benzamido-3-(4-chlorophenyl)-4-cyano-4-pentenoic acid IUPAC Name: (2R,3S)-2-benzamido-3-(4-chlorophenyl)-4-cyanopent-4-enoic acid Traditional Name: (2R,3S)-2-benzamido-3-(4-chlorophenyl)-4-cyano-pent-4-enoic acid Formula: C19H15ClN2O3 MolecularWeight: 354.787

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15ClN2O3/c1-12(11-21)16(13-7-9-15(20)10-8-13)17(19(24)25)22-18(23)14-5-3-2-4-6-14/h2-10,16-17H,1H2,(H,22,23)(H,24,25)/t16-,17-/m1/s1