(3R)-3-methyl-2-(4-methylphenyl)sulfonyl-nonanenitrile

Systemtic Name: (3R)-3-methyl-2-(4-methylphenyl)sulfonyl-nonanenitrile Openeye Name: (3R)-3-methyl-2-(p-tolylsulfonyl)nonanenitrile CAS Name: (3R)-3-methyl-2-(4-methylphenyl)sulfonylnonanenitrile IUPAC Name: (3R)-3-methyl-2-(4-methylphenyl)sulfonylnonanenitrile Traditional Name: (3R)-3-methyl-2-tosyl-pelargononitrile Formula: C17H25NO2S MolecularWeight: 307.4509

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C(C#N)S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCC[C@@H](C)C(C#N)S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C17H25NO2S/c1-4-5-6-7-8-15(3)17(13-18)21(19,20)16-11-9-14(2)10-12-16/h9-12,15,17H,4-8H2,1-3H3/t15-,17?/m1/s1