3-[[3-[(3-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid

Systemtic Name: 3-[[3-[(3-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Openeye Name: 3-[[3-[(3-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid CAS Name: 3-[[3-[(3-nitroanilino)-oxomethyl]phenyl]sulfonylamino]benzoic acid IUPAC Name: 3-[[3-[(3-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Traditional Name: 3-[[3-[(3-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Formula: C20H15N3O7S MolecularWeight: 441.414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N3O7S/c24-19(21-15-6-3-8-17(12-15)23(27)28)13-4-2-9-18(11-13)31(29,30)22-16-7-1-5-14(10-16)20(25)26/h1-12,22H,(H,21,24)(H,25,26)