[(4-nitrophenyl)sulfonyl-phenyl-amino] 4-nitrobenzenesulfonate

Systemtic Name: [(4-nitrophenyl)sulfonyl-phenyl-amino] 4-nitrobenzenesulfonate Openeye Name: (N-(4-nitrophenyl)sulfonylanilino) 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid (N-(4-nitrophenyl)sulfonylanilino) ester IUPAC Name: (N-(4-nitrophenyl)sulfonylanilino) 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid (N-nosylanilino) ester Formula: C18H13N3O9S2 MolecularWeight: 479.44052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(OS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N(OS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O9S2/c22-19(23)14-6-10-17(11-7-14)31(26,27)21(16-4-2-1-3-5-16)30-32(28,29)18-12-8-15(9-13-18)20(24)25/h1-13H