N4,N4-dimethyl-N1-(3-methylbutan-2-yl)-2-nitro-benzene-1,4-disulfonamide

Systemtic Name: N4,N4-dimethyl-N1-(3-methylbutan-2-yl)-2-nitro-benzene-1,4-disulfonamide Openeye Name: N1-(1,2-dimethylpropyl)-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide CAS Name: N4,N4-dimethyl-N1-(3-methylbutan-2-yl)-2-nitrobenzene-1,4-disulfonamide IUPAC Name: 4-N,4-N-dimethyl-1-N-(3-methylbutan-2-yl)-2-nitrobenzene-1,4-disulfonamide Traditional Name: N-(1,2-dimethylpropyl)-N',N'-dimethyl-2-nitro-benzene-1,4-disulfonamide Formula: C13H21N3O6S2 MolecularWeight: 379.45234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O6S2/c1-9(2)10(3)14-23(19,20)13-7-6-11(8-12(13)16(17)18)24(21,22)15(4)5/h6-10,14H,1-5H3