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

Systemtic Name: 4-[4-chloranyl-3-(trifluoromethyl)phenyl]-1-(4-propylphenyl)sulfonyl-piperidin-4-ol Openeye Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-1-(4-propylphenyl)sulfonyl-piperidin-4-ol CAS Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-1-(4-propylphenyl)sulfonyl-4-piperidinol IUPAC Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-1-(4-propylphenyl)sulfonylpiperidin-4-ol Traditional Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]-1-(4-propylphenyl)sulfonyl-piperidin-4-ol Formula: C21H23ClF3NO3S MolecularWeight: 461.92543

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC(=C(C=C3)Cl)C(F)(F)F)O

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC(=C(C=C3)Cl)C(F)(F)F)O

InChI

InChI=1S/C21H23ClF3NO3S/c1-2-3-15-4-7-17(8-5-15)30(28,29)26-12-10-20(27,11-13-26)16-6-9-19(22)18(14-16)21(23,24)25/h4-9,14,27H,2-3,10-13H2,1H3