N-methyl-4-[[(1S,2S)-2-methylcyclohexyl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-methyl-4-[[(1S,2S)-2-methylcyclohexyl]amino]-3-nitro-benzenesulfonamide Openeye Name: N-methyl-4-[[(1S,2S)-2-methylcyclohexyl]amino]-3-nitro-benzenesulfonamide CAS Name: N-methyl-4-[[(1S,2S)-2-methylcyclohexyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: N-methyl-4-[[(1S,2S)-2-methylcyclohexyl]amino]-3-nitrobenzenesulfonamide Traditional Name: N-methyl-4-[[(1S,2S)-2-methylcyclohexyl]amino]-3-nitro-benzenesulfonamide Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O4S/c1-10-5-3-4-6-12(10)16-13-8-7-11(22(20,21)15-2)9-14(13)17(18)19/h7-10,12,15-16H,3-6H2,1-2H3/t10-,12-/m0/s1