2-(1-propylpiperidin-4-yl)-6-(trifluoromethylsulfonyl)benzenecarbonitrile

Systemtic Name: 2-(1-propylpiperidin-4-yl)-6-(trifluoromethylsulfonyl)benzenecarbonitrile Openeye Name: 2-(1-propyl-4-piperidyl)-6-(trifluoromethylsulfonyl)benzonitrile CAS Name: 2-(1-propyl-4-piperidinyl)-6-(trifluoromethylsulfonyl)benzonitrile IUPAC Name: 2-(1-propylpiperidin-4-yl)-6-(trifluoromethylsulfonyl)benzonitrile Traditional Name: 2-(1-propyl-4-piperidyl)-6-triflyl-benzonitrile Formula: C16H19F3N2O2S MolecularWeight: 360.39447

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)C2=C(C(=CC=C2)S(=O)(=O)C(F)(F)F)C#N

Isomeric SMILES

CCCN1CCC(CC1)C2=C(C(=CC=C2)S(=O)(=O)C(F)(F)F)C#N

InChI

InChI=1S/C16H19F3N2O2S/c1-2-8-21-9-6-12(7-10-21)13-4-3-5-15(14(13)11-20)24(22,23)16(17,18)19/h3-5,12H,2,6-10H2,1H3