4-[[4-chloranyl-3-[(5-chloranyl-2-methoxy-phenyl)sulfonylamino]phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-[[4-chloranyl-3-[(5-chloranyl-2-methoxy-phenyl)sulfonylamino]phenyl]carbonylamino]benzoic acid Openeye Name: 4-[[4-chloro-3-[(5-chloro-2-methoxy-phenyl)sulfonylamino]benzoyl]amino]benzoic acid CAS Name: 4-[[[4-chloro-3-[(5-chloro-2-methoxyphenyl)sulfonylamino]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[4-chloro-3-[(5-chloro-2-methoxyphenyl)sulfonylamino]benzoyl]amino]benzoic acid Traditional Name: 4-[[4-chloro-3-[(5-chloro-2-methoxy-phenyl)sulfonylamino]benzoyl]amino]benzoic acid Formula: C21H16Cl2N2O6S MolecularWeight: 495.33254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=O)O)Cl

InChI

InChI=1S/C21H16Cl2N2O6S/c1-31-18-9-5-14(22)11-19(18)32(29,30)25-17-10-13(4-8-16(17)23)20(26)24-15-6-2-12(3-7-15)21(27)28/h2-11,25H,1H3,(H,24,26)(H,27,28)