3-[[4-chloranyl-3-[(2-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid

Systemtic Name: 3-[[4-chloranyl-3-[(2-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Openeye Name: 3-[[4-chloro-3-[(2-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid CAS Name: 3-[[4-chloro-3-[(2-nitroanilino)-oxomethyl]phenyl]sulfonylamino]benzoic acid IUPAC Name: 3-[[4-chloro-3-[(2-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Traditional Name: 3-[[4-chloro-3-[(2-nitrophenyl)carbamoyl]phenyl]sulfonylamino]benzoic acid Formula: C20H14ClN3O7S MolecularWeight: 475.85906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14ClN3O7S/c21-16-9-8-14(32(30,31)23-13-5-3-4-12(10-13)20(26)27)11-15(16)19(25)22-17-6-1-2-7-18(17)24(28)29/h1-11,23H,(H,22,25)(H,26,27)