N-(3-chloranyl-4-ethanoyl-phenyl)-1-phenyl-N-(phenylmethyl)sulfonyl-methanesulfonamide

Systemtic Name: N-(3-chloranyl-4-ethanoyl-phenyl)-1-phenyl-N-(phenylmethyl)sulfonyl-methanesulfonamide Openeye Name: N-(4-acetyl-3-chloro-phenyl)-N-benzylsulfonyl-1-phenyl-methanesulfonamide CAS Name: N-(4-acetyl-3-chlorophenyl)-1-phenyl-N-(phenylmethyl)sulfonylmethanesulfonamide IUPAC Name: N-(4-acetyl-3-chlorophenyl)-N-benzylsulfonyl-1-phenylmethanesulfonamide Traditional Name: N-(4-acetyl-3-chloro-phenyl)-N-benzylsulfonyl-1-phenyl-methanesulfonamide Formula: C22H20ClNO5S2 MolecularWeight: 477.9809

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)N(S(=O)(=O)CC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3)Cl

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)N(S(=O)(=O)CC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H20ClNO5S2/c1-17(25)21-13-12-20(14-22(21)23)24(30(26,27)15-18-8-4-2-5-9-18)31(28,29)16-19-10-6-3-7-11-19/h2-14H,15-16H2,1H3