4-[5-ethoxy-3-(1-methoxy-2-methyl-propan-2-yl)-2-oxidanylidene-benzimidazol-1-yl]sulfonyl-3-methoxy-benzoic acid

Systemtic Name: 4-[5-ethoxy-3-(1-methoxy-2-methyl-propan-2-yl)-2-oxidanylidene-benzimidazol-1-yl]sulfonyl-3-methoxy-benzoic acid Openeye Name: 4-[5-ethoxy-3-(2-methoxy-1,1-dimethyl-ethyl)-2-oxo-benzimidazol-1-yl]sulfonyl-3-methoxy-benzoic acid CAS Name: 4-[[5-ethoxy-3-(1-methoxy-2-methylpropan-2-yl)-2-oxo-1-benzimidazolyl]sulfonyl]-3-methoxybenzoic acid IUPAC Name: 4-[5-ethoxy-3-(1-methoxy-2-methylpropan-2-yl)-2-oxobenzimidazol-1-yl]sulfonyl-3-methoxybenzoic acid Traditional Name: 4-[5-ethoxy-2-keto-3-(2-methoxy-1,1-dimethyl-ethyl)benzimidazol-1-yl]sulfonyl-3-methoxy-benzoic acid Formula: C22H26N2O8S MolecularWeight: 478.51544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=O)N2C(C)(C)COC)S(=O)(=O)C3=C(C=C(C=C3)C(=O)O)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=O)N2C(C)(C)COC)S(=O)(=O)C3=C(C=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C22H26N2O8S/c1-6-32-15-8-9-16-17(12-15)23(22(2,3)13-30-4)21(27)24(16)33(28,29)19-10-7-14(20(25)26)11-18(19)31-5/h7-12H,6,13H2,1-5H3,(H,25,26)