4-phenyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carbonitrile

Systemtic Name: 4-phenyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carbonitrile Openeye Name: 4-phenyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carbonitrile CAS Name: 4-phenyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarbonitrile IUPAC Name: 4-phenyl-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carbonitrile Traditional Name: 4-phenyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-isonipecotonitrile Formula: C19H17F3N2O2S MolecularWeight: 394.41069

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17F3N2O2S/c20-19(21,22)16-7-4-8-17(13-16)27(25,26)24-11-9-18(14-23,10-12-24)15-5-2-1-3-6-15/h1-8,13H,9-12H2