methyl 1-[(4-fluorophenyl)methyl]-2-(4-methoxycarbonylphenyl)benzimidazole-5-carboxylate

Systemtic Name: methyl 1-[(4-fluorophenyl)methyl]-2-(4-methoxycarbonylphenyl)benzimidazole-5-carboxylate Openeye Name: methyl 1-[(4-fluorophenyl)methyl]-2-(4-methoxycarbonylphenyl)benzimidazole-5-carboxylate CAS Name: 1-[(4-fluorophenyl)methyl]-2-(4-methoxycarbonylphenyl)-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-fluorophenyl)methyl]-2-(4-methoxycarbonylphenyl)benzimidazole-5-carboxylate Traditional Name: 2-(4-carbomethoxyphenyl)-1-(4-fluorobenzyl)benzimidazole-5-carboxylic acid methyl ester Formula: C24H19FN2O4 MolecularWeight: 418.417063

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NC3=C(N2CC4=CC=C(C=C4)F)C=CC(=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NC3=C(N2CC4=CC=C(C=C4)F)C=CC(=C3)C(=O)OC

InChI

InChI=1S/C24H19FN2O4/c1-30-23(28)17-7-5-16(6-8-17)22-26-20-13-18(24(29)31-2)9-12-21(20)27(22)14-15-3-10-19(25)11-4-15/h3-13H,14H2,1-2H3