1-[3-methyl-4-(3-methylphenyl)sulfonyl-pentyl]-4-(trifluoromethyl)piperidine

Systemtic Name: 1-[3-methyl-4-(3-methylphenyl)sulfonyl-pentyl]-4-(trifluoromethyl)piperidine Openeye Name: 1-[3-methyl-4-(m-tolylsulfonyl)pentyl]-4-(trifluoromethyl)piperidine CAS Name: 1-[3-methyl-4-(3-methylphenyl)sulfonylpentyl]-4-(trifluoromethyl)piperidine IUPAC Name: 1-[3-methyl-4-(3-methylphenyl)sulfonylpentyl]-4-(trifluoromethyl)piperidine Traditional Name: 1-[3-methyl-4-(m-tolylsulfonyl)pentyl]-4-(trifluoromethyl)piperidine Formula: C19H28F3NO2S MolecularWeight: 391.49133

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)C(C)C(C)CCN2CCC(CC2)C(F)(F)F

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)C(C)C(C)CCN2CCC(CC2)C(F)(F)F

InChI

InChI=1S/C19H28F3NO2S/c1-14-5-4-6-18(13-14)26(24,25)16(3)15(2)7-10-23-11-8-17(9-12-23)19(20,21)22/h4-6,13,15-17H,7-12H2,1-3H3