3,4-dimethyl-N-[(1R,2S)-2-methylcyclohexyl]-5-nitro-benzenesulfonamide

Systemtic Name: 3,4-dimethyl-N-[(1R,2S)-2-methylcyclohexyl]-5-nitro-benzenesulfonamide Openeye Name: 3,4-dimethyl-N-[(1R,2S)-2-methylcyclohexyl]-5-nitro-benzenesulfonamide CAS Name: 3,4-dimethyl-N-[(1R,2S)-2-methylcyclohexyl]-5-nitrobenzenesulfonamide IUPAC Name: 3,4-dimethyl-N-[(1R,2S)-2-methylcyclohexyl]-5-nitrobenzenesulfonamide Traditional Name: 3,4-dimethyl-N-[(1R,2S)-2-methylcyclohexyl]-5-nitro-benzenesulfonamide Formula: C15H22N2O4S MolecularWeight: 326.41118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NS(=O)(=O)C2=CC(=C(C(=C2)C)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[C@H]1NS(=O)(=O)C2=CC(=C(C(=C2)C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H22N2O4S/c1-10-6-4-5-7-14(10)16-22(20,21)13-8-11(2)12(3)15(9-13)17(18)19/h8-10,14,16H,4-7H2,1-3H3/t10-,14+/m0/s1