3-[4-(2-methylphenyl)phenyl]-2-[(2-methylsulfonylphenyl)carbonylamino]propanoic acid

Systemtic Name: 3-[4-(2-methylphenyl)phenyl]-2-[(2-methylsulfonylphenyl)carbonylamino]propanoic acid Openeye Name: 2-[(2-methylsulfonylbenzoyl)amino]-3-[4-(o-tolyl)phenyl]propanoic acid CAS Name: 3-[4-(2-methylphenyl)phenyl]-2-[[(2-methylsulfonylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[4-(2-methylphenyl)phenyl]-2-[(2-methylsulfonylbenzoyl)amino]propanoic acid Traditional Name: 2-[(2-mesylbenzoyl)amino]-3-[4-(o-tolyl)phenyl]propionic acid Formula: C24H23NO5S MolecularWeight: 437.50812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C24H23NO5S/c1-16-7-3-4-8-19(16)18-13-11-17(12-14-18)15-21(24(27)28)25-23(26)20-9-5-6-10-22(20)31(2,29)30/h3-14,21H,15H2,1-2H3,(H,25,26)(H,27,28)