N-(1-cyanooctan-2-yl)-4-methyl-benzenesulfonamide

Systemtic Name: N-(1-cyanooctan-2-yl)-4-methyl-benzenesulfonamide Openeye Name: N-[1-(cyanomethyl)heptyl]-4-methyl-benzenesulfonamide CAS Name: N-(1-cyanooctan-2-yl)-4-methylbenzenesulfonamide IUPAC Name: N-(1-cyanooctan-2-yl)-4-methylbenzenesulfonamide Traditional Name: N-[1-(cyanomethyl)heptyl]-4-methyl-benzenesulfonamide Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O2S/c1-3-4-5-6-7-15(12-13-17)18-21(19,20)16-10-8-14(2)9-11-16/h8-11,15,18H,3-7,12H2,1-2H3