benzimidazol-1-ylsulfonyl 3-ethoxy-5-methoxy-6-oxidanylidene-5-pyridin-2-yl-cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: benzimidazol-1-ylsulfonyl 3-ethoxy-5-methoxy-6-oxidanylidene-5-pyridin-2-yl-cyclohexa-1,3-diene-1-carboxylate Openeye Name: benzimidazol-1-ylsulfonyl 3-ethoxy-5-methoxy-6-oxo-5-(2-pyridyl)cyclohexa-1,3-diene-1-carboxylate CAS Name: 3-ethoxy-5-methoxy-6-oxo-5-(2-pyridinyl)-1-cyclohexa-1,3-dienecarboxylic acid 1-benzimidazolylsulfonyl ester IUPAC Name: benzimidazol-1-ylsulfonyl 3-ethoxy-5-methoxy-6-oxo-5-pyridin-2-ylcyclohexa-1,3-diene-1-carboxylate Traditional Name: 3-ethoxy-6-keto-5-methoxy-5-(2-pyridyl)cyclohexa-1,3-diene-1-carboxylic acid benzimidazol-1-ylsulfonyl ester Formula: C22H19N3O7S MolecularWeight: 469.46716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(C(=O)C(=C1)C(=O)OS(=O)(=O)N2C=NC3=CC=CC=C32)(C4=CC=CC=N4)OC

Isomeric SMILES

CCOC1=CC(C(=O)C(=C1)C(=O)OS(=O)(=O)N2C=NC3=CC=CC=C32)(C4=CC=CC=N4)OC

InChI

InChI=1S/C22H19N3O7S/c1-3-31-15-12-16(20(26)22(13-15,30-2)19-10-6-7-11-23-19)21(27)32-33(28,29)25-14-24-17-8-4-5-9-18(17)25/h4-14H,3H2,1-2H3