4-(4-azanyl-3-nitro-phenyl)sulfonyl-2-nitro-aniline dihydrochloride

Systemtic Name: 4-(4-azanyl-3-nitro-phenyl)sulfonyl-2-nitro-aniline dihydrochloride Openeye Name: 4-(4-amino-3-nitro-phenyl)sulfonyl-2-nitro-aniline dihydrochloride CAS Name: 4-(4-amino-3-nitrophenyl)sulfonyl-2-nitroaniline dihydrochloride IUPAC Name: 4-(4-amino-3-nitrophenyl)sulfonyl-2-nitroaniline dihydrochloride Traditional Name: [4-(4-amino-3-nitro-phenyl)sulfonyl-2-nitro-phenyl]amine dihydrochloride Formula: C12H12Cl2N4O6S MolecularWeight: 411.21788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])[N+](=O)[O-])N.Cl.Cl

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])[N+](=O)[O-])N.Cl.Cl

InChI

InChI=1S/C12H10N4O6S.2ClH/c13-9-3-1-7(5-11(9)15(17)18)23(21,22)8-2-4-10(14)12(6-8)16(19)20;;/h1-6H,13-14H2;2*1H