(4-nitrophenyl) 3-[(2-nitrophenyl)carbamoyl]benzenesulfonate

Systemtic Name: (4-nitrophenyl) 3-[(2-nitrophenyl)carbamoyl]benzenesulfonate Openeye Name: (4-nitrophenyl) 3-[(2-nitrophenyl)carbamoyl]benzenesulfonate CAS Name: 3-[(2-nitroanilino)-oxomethyl]benzenesulfonic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-[(2-nitrophenyl)carbamoyl]benzenesulfonate Traditional Name: 3-[(2-nitrophenyl)carbamoyl]benzenesulfonic acid (4-nitrophenyl) ester Formula: C19H13N3O8S MolecularWeight: 443.38682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)OC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)OC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O8S/c23-19(20-17-6-1-2-7-18(17)22(26)27)13-4-3-5-16(12-13)31(28,29)30-15-10-8-14(9-11-15)21(24)25/h1-12H,(H,20,23)