N4,N4-dimethyl-N1-(6-methylheptan-2-yl)-2-nitro-benzene-1,4-disulfonamide

Systemtic Name: N4,N4-dimethyl-N1-(6-methylheptan-2-yl)-2-nitro-benzene-1,4-disulfonamide Openeye Name: N1-(1,5-dimethylhexyl)-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide CAS Name: N4,N4-dimethyl-N1-(6-methylheptan-2-yl)-2-nitrobenzene-1,4-disulfonamide IUPAC Name: 4-N,4-N-dimethyl-1-N-(6-methylheptan-2-yl)-2-nitrobenzene-1,4-disulfonamide Traditional Name: N-(1,5-dimethylhexyl)-N',N'-dimethyl-2-nitro-benzene-1,4-disulfonamide Formula: C16H27N3O6S2 MolecularWeight: 421.53208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NS(=O)(=O)C1=C(C=C(C=C1)S(=O)(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCCC(C)NS(=O)(=O)C1=C(C=C(C=C1)S(=O)(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H27N3O6S2/c1-12(2)7-6-8-13(3)17-26(22,23)16-10-9-14(11-15(16)19(20)21)27(24,25)18(4)5/h9-13,17H,6-8H2,1-5H3