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

Systemtic Name: [ethoxycarbonyl-(4-nitrophenyl)sulfonyl-amino] 4-nitrobenzenesulfonate Openeye Name: [ethoxycarbonyl-(4-nitrophenyl)sulfonyl-amino] 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid [ethoxycarbonyl-(4-nitrophenyl)sulfonylamino] ester IUPAC Name: [ethoxycarbonyl-(4-nitrophenyl)sulfonylamino] 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid [carbethoxy(nosyl)amino] ester Formula: C15H13N3O11S2 MolecularWeight: 475.40722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O11S2/c1-2-28-15(19)18(30(24,25)13-7-3-11(4-8-13)16(20)21)29-31(26,27)14-9-5-12(6-10-14)17(22)23/h3-10H,2H2,1H3