1-(4-butylphenyl)sulfonyl-4-[4-chloranyl-3-(trifluoromethyl)phenyl]piperidin-4-ol

Systemtic Name: 1-(4-butylphenyl)sulfonyl-4-[4-chloranyl-3-(trifluoromethyl)phenyl]piperidin-4-ol Openeye Name: 1-(4-butylphenyl)sulfonyl-4-[4-chloro-3-(trifluoromethyl)phenyl]piperidin-4-ol CAS Name: 1-(4-butylphenyl)sulfonyl-4-[4-chloro-3-(trifluoromethyl)phenyl]-4-piperidinol IUPAC Name: 1-(4-butylphenyl)sulfonyl-4-[4-chloro-3-(trifluoromethyl)phenyl]piperidin-4-ol Traditional Name: 1-(4-butylphenyl)sulfonyl-4-[4-chloro-3-(trifluoromethyl)phenyl]piperidin-4-ol Formula: C22H25ClF3NO3S MolecularWeight: 475.95201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC(=C(C=C3)Cl)C(F)(F)F)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC(=C(C=C3)Cl)C(F)(F)F)O

InChI

InChI=1S/C22H25ClF3NO3S/c1-2-3-4-16-5-8-18(9-6-16)31(29,30)27-13-11-21(28,12-14-27)17-7-10-20(23)19(15-17)22(24,25)26/h5-10,15,28H,2-4,11-14H2,1H3