N1-[(4-dimethylaminophenyl)methyl]-N1-ethyl-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide

Systemtic Name: N1-[(4-dimethylaminophenyl)methyl]-N1-ethyl-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide Openeye Name: N1-[(4-dimethylaminophenyl)methyl]-N1-ethyl-N4,N4-dimethyl-2-nitro-benzene-1,4-disulfonamide CAS Name: N1-[(4-dimethylaminophenyl)methyl]-N1-ethyl-N4,N4-dimethyl-2-nitrobenzene-1,4-disulfonamide IUPAC Name: 1-N-[(4-dimethylaminophenyl)methyl]-1-N-ethyl-4-N,4-N-dimethyl-2-nitrobenzene-1,4-disulfonamide Traditional Name: N-[4-(dimethylamino)benzyl]-N-ethyl-N',N'-dimethyl-2-nitro-benzene-1,4-disulfonamide Formula: C19H26N4O6S2 MolecularWeight: 470.56294

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)N(C)C)S(=O)(=O)C2=C(C=C(C=C2)S(=O)(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CC=C(C=C1)N(C)C)S(=O)(=O)C2=C(C=C(C=C2)S(=O)(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H26N4O6S2/c1-6-22(14-15-7-9-16(10-8-15)20(2)3)31(28,29)19-12-11-17(13-18(19)23(24)25)30(26,27)21(4)5/h7-13H,6,14H2,1-5H3