2,2-bis(4-fluorophenyl)-2-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]ethanenitrile

Systemtic Name: 2,2-bis(4-fluorophenyl)-2-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]ethanenitrile Openeye Name: 2,2-bis(4-fluorophenyl)-2-[1-(p-tolylsulfonyl)-4-piperidyl]acetonitrile CAS Name: 2,2-bis(4-fluorophenyl)-2-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]acetonitrile IUPAC Name: 2,2-bis(4-fluorophenyl)-2-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]acetonitrile Traditional Name: 2,2-bis(4-fluorophenyl)-2-(1-tosyl-4-piperidyl)acetonitrile Formula: C26H24F2N2O2S MolecularWeight: 466.542766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(C#N)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(C#N)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H24F2N2O2S/c1-19-2-12-25(13-3-19)33(31,32)30-16-14-22(15-17-30)26(18-29,20-4-8-23(27)9-5-20)21-6-10-24(28)11-7-21/h2-13,22H,14-17H2,1H3