3-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-oxidanyl-piperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 3-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-oxidanyl-piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 3-[[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxy-1-piperidyl]sulfonyl]benzonitrile CAS Name: 3-[[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxy-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 3-[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxypiperidin-1-yl]sulfonylbenzonitrile Traditional Name: 3-[4-[4-chloro-3-(trifluoromethyl)phenyl]-4-hydroxy-piperidino]sulfonylbenzonitrile Formula: C19H16ClF3N2O3S MolecularWeight: 444.85515

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O)S(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O)S(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H16ClF3N2O3S/c20-17-5-4-14(11-16(17)19(21,22)23)18(26)6-8-25(9-7-18)29(27,28)15-3-1-2-13(10-15)12-24/h1-5,10-11,26H,6-9H2