methyl 3-[(3-chloranyl-4-methoxy-phenyl)methyl]-1-(4-oxidanylcyclohexyl)-2-oxidanylidene-benzimidazole-5-carboxylate

Systemtic Name: methyl 3-[(3-chloranyl-4-methoxy-phenyl)methyl]-1-(4-oxidanylcyclohexyl)-2-oxidanylidene-benzimidazole-5-carboxylate Openeye Name: methyl 3-[(3-chloro-4-methoxy-phenyl)methyl]-1-(4-hydroxycyclohexyl)-2-oxo-benzimidazole-5-carboxylate CAS Name: 3-[(3-chloro-4-methoxyphenyl)methyl]-1-(4-hydroxycyclohexyl)-2-oxo-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[(3-chloro-4-methoxyphenyl)methyl]-1-(4-hydroxycyclohexyl)-2-oxobenzimidazole-5-carboxylate Traditional Name: 3-(3-chloro-4-methoxy-benzyl)-1-(4-hydroxycyclohexyl)-2-keto-benzimidazole-5-carboxylic acid methyl ester Formula: C23H25ClN2O5 MolecularWeight: 444.908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)C(=O)OC)N(C2=O)C4CCC(CC4)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)C(=O)OC)N(C2=O)C4CCC(CC4)O)Cl

InChI

InChI=1S/C23H25ClN2O5/c1-30-21-10-3-14(11-18(21)24)13-25-20-12-15(22(28)31-2)4-9-19(20)26(23(25)29)16-5-7-17(27)8-6-16/h3-4,9-12,16-17,27H,5-8,13H2,1-2H3