2-[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]-2,2-diphenyl-ethanenitrile

Systemtic Name: 2-[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]-2,2-diphenyl-ethanenitrile Openeye Name: 2,2-diphenyl-2-[(3R)-1-(p-tolylsulfonyl)-3-piperidyl]acetonitrile CAS Name: 2-[(3R)-1-(4-methylphenyl)sulfonyl-3-piperidinyl]-2,2-diphenylacetonitrile IUPAC Name: 2-[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]-2,2-diphenylacetonitrile Traditional Name: 2,2-diphenyl-2-[(3R)-1-tosyl-3-piperidyl]acetonitrile Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)C(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H26N2O2S/c1-21-14-16-25(17-15-21)31(29,30)28-18-8-13-24(19-28)26(20-27,22-9-4-2-5-10-22)23-11-6-3-7-12-23/h2-7,9-12,14-17,24H,8,13,18-19H2,1H3/t24-/m0/s1