4-methyl-N-[2-nitro-5-[4-(trifluoromethyl)phenyl]carbonyl-phenyl]cyclohexane-1-sulfonamide

Systemtic Name: 4-methyl-N-[2-nitro-5-[4-(trifluoromethyl)phenyl]carbonyl-phenyl]cyclohexane-1-sulfonamide Openeye Name: 4-methyl-N-[2-nitro-5-[4-(trifluoromethyl)benzoyl]phenyl]cyclohexanesulfonamide CAS Name: 4-methyl-N-[2-nitro-5-[oxo-[4-(trifluoromethyl)phenyl]methyl]phenyl]-1-cyclohexanesulfonamide IUPAC Name: 4-methyl-N-[2-nitro-5-[4-(trifluoromethyl)benzoyl]phenyl]cyclohexane-1-sulfonamide Traditional Name: 4-methyl-N-[2-nitro-5-[4-(trifluoromethyl)benzoyl]phenyl]cyclohexanesulfonamide Formula: C21H21F3N2O5S MolecularWeight: 470.46205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)C3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)C3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H21F3N2O5S/c1-13-2-9-17(10-3-13)32(30,31)25-18-12-15(6-11-19(18)26(28)29)20(27)14-4-7-16(8-5-14)21(22,23)24/h4-8,11-13,17,25H,2-3,9-10H2,1H3