N-[2-chloranyl-5-oxidanyl-4-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]phenyl]-2-(3-methylphenyl)sulfonyl-butanamide

Systemtic Name: N-[2-chloranyl-5-oxidanyl-4-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]phenyl]-2-(3-methylphenyl)sulfonyl-butanamide Openeye Name: N-[2-chloro-5-hydroxy-4-[2-oxo-2-(4-phenylphenyl)ethyl]phenyl]-2-(m-tolylsulfonyl)butanamide CAS Name: N-[2-chloro-5-hydroxy-4-[2-oxo-2-(4-phenylphenyl)ethyl]phenyl]-2-(3-methylphenyl)sulfonylbutanamide IUPAC Name: N-[2-chloro-5-hydroxy-4-[2-oxo-2-(4-phenylphenyl)ethyl]phenyl]-2-(3-methylphenyl)sulfonylbutanamide Traditional Name: N-[2-chloro-5-hydroxy-4-[2-keto-2-(4-phenylphenyl)ethyl]phenyl]-2-(m-tolylsulfonyl)butyramide Formula: C31H28ClNO5S MolecularWeight: 562.07572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C(=C1)O)CC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)Cl)S(=O)(=O)C4=CC=CC(=C4)C

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C(=C1)O)CC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)Cl)S(=O)(=O)C4=CC=CC(=C4)C

InChI

InChI=1S/C31H28ClNO5S/c1-3-30(39(37,38)25-11-7-8-20(2)16-25)31(36)33-27-19-29(35)24(17-26(27)32)18-28(34)23-14-12-22(13-15-23)21-9-5-4-6-10-21/h4-17,19,30,35H,3,18H2,1-2H3,(H,33,36)