N1,N4,N4-trimethyl-N1-(4-methylcyclohexyl)-2-nitro-benzene-1,4-disulfonamide

Systemtic Name: N1,N4,N4-trimethyl-N1-(4-methylcyclohexyl)-2-nitro-benzene-1,4-disulfonamide Openeye Name: N1,N4,N4-trimethyl-N1-(4-methylcyclohexyl)-2-nitro-benzene-1,4-disulfonamide CAS Name: N1,N4,N4-trimethyl-N1-(4-methylcyclohexyl)-2-nitrobenzene-1,4-disulfonamide IUPAC Name: 1-N,4-N,4-N-trimethyl-1-N-(4-methylcyclohexyl)-2-nitrobenzene-1,4-disulfonamide Traditional Name: N,N',N'-trimethyl-N-(4-methylcyclohexyl)-2-nitro-benzene-1,4-disulfonamide Formula: C16H25N3O6S2 MolecularWeight: 419.5162

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N(C)S(=O)(=O)C2=C(C=C(C=C2)S(=O)(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)N(C)S(=O)(=O)C2=C(C=C(C=C2)S(=O)(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H25N3O6S2/c1-12-5-7-13(8-6-12)18(4)27(24,25)16-10-9-14(11-15(16)19(20)21)26(22,23)17(2)3/h9-13H,5-8H2,1-4H3