N1-heptan-2-yl-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide

Systemtic Name: N1-heptan-2-yl-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide Openeye Name: N4,N4-dimethyl-N1-(1-methylhexyl)-2-nitro-benzene-1,4-disulfonamide CAS Name: N1-heptan-2-yl-N4,N4-dimethyl-2-nitrobenzene-1,4-disulfonamide IUPAC Name: 1-N-heptan-2-yl-4-N,4-N-dimethyl-2-nitrobenzene-1,4-disulfonamide Traditional Name: N',N'-dimethyl-N-(1-methylhexyl)-2-nitro-benzene-1,4-disulfonamide Formula: C15H25N3O6S2 MolecularWeight: 407.5055

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3O6S2/c1-5-6-7-8-12(2)16-25(21,22)15-10-9-13(11-14(15)18(19)20)26(23,24)17(3)4/h9-12,16H,5-8H2,1-4H3