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

Systemtic Name: 2-[[3-(4-methylsulfonylphenyl)phenyl]carbonylamino]-3-(4-phenylphenyl)propanoic acid Openeye Name: 2-[[3-(4-methylsulfonylphenyl)benzoyl]amino]-3-(4-phenylphenyl)propanoic acid CAS Name: 2-[[[3-(4-methylsulfonylphenyl)phenyl]-oxomethyl]amino]-3-(4-phenylphenyl)propanoic acid IUPAC Name: 2-[[3-(4-methylsulfonylphenyl)benzoyl]amino]-3-(4-phenylphenyl)propanoic acid Traditional Name: 2-[[3-(4-mesylphenyl)benzoyl]amino]-3-(4-phenylphenyl)propionic acid Formula: C29H25NO5S MolecularWeight: 499.5775

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)NC(CC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)NC(CC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C29H25NO5S/c1-36(34,35)26-16-14-23(15-17-26)24-8-5-9-25(19-24)28(31)30-27(29(32)33)18-20-10-12-22(13-11-20)21-6-3-2-4-7-21/h2-17,19,27H,18H2,1H3,(H,30,31)(H,32,33)