3-chloranyl-5-methoxy-4-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonyloxy]benzoic acid

Systemtic Name: 3-chloranyl-5-methoxy-4-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonyloxy]benzoic acid Openeye Name: 3-chloro-5-methoxy-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyloxy]benzoic acid CAS Name: 3-chloro-5-methoxy-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyloxy]benzoic acid IUPAC Name: 3-chloro-5-methoxy-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyloxy]benzoic acid Traditional Name: 3-chloro-4-[(2-keto-1,3-dihydrobenzimidazol-5-yl)sulfonyloxy]-5-methoxy-benzoic acid Formula: C15H11ClN2O7S MolecularWeight: 398.77504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC3=C(C=C2)NC(=O)N3

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)O)Cl)OS(=O)(=O)C2=CC3=C(C=C2)NC(=O)N3

InChI

InChI=1S/C15H11ClN2O7S/c1-24-12-5-7(14(19)20)4-9(16)13(12)25-26(22,23)8-2-3-10-11(6-8)18-15(21)17-10/h2-6H,1H3,(H,19,20)(H2,17,18,21)