2-[4-(2-chlorophenyl)phenyl]-2-phenylmethoxycarbonylsulfanyl-propanoic acid

Systemtic Name: 2-[4-(2-chlorophenyl)phenyl]-2-phenylmethoxycarbonylsulfanyl-propanoic acid Openeye Name: 2-benzyloxycarbonylsulfanyl-2-[4-(2-chlorophenyl)phenyl]propanoic acid CAS Name: 2-[4-(2-chlorophenyl)phenyl]-2-(phenylmethoxycarbonylthio)propanoic acid IUPAC Name: 2-[4-(2-chlorophenyl)phenyl]-2-phenylmethoxycarbonylsulfanylpropanoic acid Traditional Name: 2-(carbobenzoxythio)-2-[4-(2-chlorophenyl)phenyl]propionic acid Formula: C23H19ClO4S MolecularWeight: 426.91256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=CC=CC=C2Cl)(C(=O)O)SC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=C(C=C1)C2=CC=CC=C2Cl)(C(=O)O)SC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H19ClO4S/c1-23(21(25)26,29-22(27)28-15-16-7-3-2-4-8-16)18-13-11-17(12-14-18)19-9-5-6-10-20(19)24/h2-14H,15H2,1H3,(H,25,26)