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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)OC2=CC=CC(=C2)[N+](=O)[O-])C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)OC2=CC=CC(=C2)[N+](=O)[O-])C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

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