4-[[3-[(3-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid

Systemtic Name: 4-[[3-[(3-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Openeye Name: 4-[[3-[(3-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid CAS Name: 4-[[3-[(3-nitroanilino)-oxomethyl]phenyl]sulfonylamino]benzoic acid IUPAC Name: 4-[[3-[(3-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Traditional Name: 4-[[3-[(3-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Formula: C20H15N3O7S MolecularWeight: 441.414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

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