methyl 4-(benzimidazol-1-yl)-5-cyclohexyl-3-ethoxy-5-methoxy-6-oxidanylidene-cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: methyl 4-(benzimidazol-1-yl)-5-cyclohexyl-3-ethoxy-5-methoxy-6-oxidanylidene-cyclohexa-1,3-diene-1-carboxylate Openeye Name: methyl 4-(benzimidazol-1-yl)-5-cyclohexyl-3-ethoxy-5-methoxy-6-oxo-cyclohexa-1,3-diene-1-carboxylate CAS Name: 4-(1-benzimidazolyl)-5-cyclohexyl-3-ethoxy-5-methoxy-6-oxo-1-cyclohexa-1,3-dienecarboxylic acid methyl ester IUPAC Name: methyl 4-(benzimidazol-1-yl)-5-cyclohexyl-3-ethoxy-5-methoxy-6-oxocyclohexa-1,3-diene-1-carboxylate Traditional Name: 4-(benzimidazol-1-yl)-5-cyclohexyl-3-ethoxy-6-keto-5-methoxy-cyclohexa-1,3-diene-1-carboxylic acid methyl ester Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(C(=O)C(=C1)C(=O)OC)(C2CCCCC2)OC)N3C=NC4=CC=CC=C43

Isomeric SMILES

CCOC1=C(C(C(=O)C(=C1)C(=O)OC)(C2CCCCC2)OC)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C24H28N2O5/c1-4-31-20-14-17(23(28)29-2)22(27)24(30-3,16-10-6-5-7-11-16)21(20)26-15-25-18-12-8-9-13-19(18)26/h8-9,12-16H,4-7,10-11H2,1-3H3