methyl 4-[5-ethoxy-3-(oxan-4-yl)-2-oxidanylidene-benzimidazol-1-yl]sulfonyl-3-methoxy-benzoate

Systemtic Name: methyl 4-[5-ethoxy-3-(oxan-4-yl)-2-oxidanylidene-benzimidazol-1-yl]sulfonyl-3-methoxy-benzoate Openeye Name: methyl 4-(5-ethoxy-2-oxo-3-tetrahydropyran-4-yl-benzimidazol-1-yl)sulfonyl-3-methoxy-benzoate CAS Name: 4-[[5-ethoxy-3-(4-oxanyl)-2-oxo-1-benzimidazolyl]sulfonyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[5-ethoxy-3-(oxan-4-yl)-2-oxobenzimidazol-1-yl]sulfonyl-3-methoxybenzoate Traditional Name: 4-(5-ethoxy-2-keto-3-tetrahydropyran-4-yl-benzimidazol-1-yl)sulfonyl-3-methoxy-benzoic acid methyl ester Formula: C23H26N2O8S MolecularWeight: 490.52614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=O)N2C3CCOCC3)S(=O)(=O)C4=C(C=C(C=C4)C(=O)OC)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=O)N2C3CCOCC3)S(=O)(=O)C4=C(C=C(C=C4)C(=O)OC)OC

InChI

InChI=1S/C23H26N2O8S/c1-4-33-17-6-7-18-19(14-17)24(16-9-11-32-12-10-16)23(27)25(18)34(28,29)21-8-5-15(22(26)31-3)13-20(21)30-2/h5-8,13-14,16H,4,9-12H2,1-3H3