N-[(3R,4R)-4-cyanohexan-3-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(3R,4R)-4-cyanohexan-3-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R,2R)-2-cyano-1-ethyl-butyl]-4-methyl-benzenesulfonamide CAS Name: N-[(3R,4R)-4-cyanohexan-3-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(3R,4R)-4-cyanohexan-3-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R,2R)-2-cyano-1-ethyl-butyl]-4-methyl-benzenesulfonamide Formula: C14H20N2O2S MolecularWeight: 280.3858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O2S/c1-4-12(10-15)14(5-2)16-19(17,18)13-8-6-11(3)7-9-13/h6-9,12,14,16H,4-5H2,1-3H3/t12-,14+/m0/s1