1-[1-[(3,5-diethoxy-4-ethoxycarbonyl-phenyl)methyl]piperidin-4-yl]-2-methyl-benzimidazole-5-carboxylic acid

Systemtic Name: 1-[1-[(3,5-diethoxy-4-ethoxycarbonyl-phenyl)methyl]piperidin-4-yl]-2-methyl-benzimidazole-5-carboxylic acid Openeye Name: 1-[1-[(3,5-diethoxy-4-ethoxycarbonyl-phenyl)methyl]-4-piperidyl]-2-methyl-benzimidazole-5-carboxylic acid CAS Name: 1-[1-[(3,5-diethoxy-4-ethoxycarbonylphenyl)methyl]-4-piperidinyl]-2-methyl-5-benzimidazolecarboxylic acid IUPAC Name: 1-[1-[(3,5-diethoxy-4-ethoxycarbonylphenyl)methyl]piperidin-4-yl]-2-methylbenzimidazole-5-carboxylic acid Traditional Name: 1-[1-(4-carbethoxy-3,5-diethoxy-benzyl)-4-piperidyl]-2-methyl-benzimidazole-5-carboxylic acid Formula: C28H35N3O6 MolecularWeight: 509.594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C(=O)OCC)OCC)CN2CCC(CC2)N3C(=NC4=C3C=CC(=C4)C(=O)O)C

Isomeric SMILES

CCOC1=CC(=CC(=C1C(=O)OCC)OCC)CN2CCC(CC2)N3C(=NC4=C3C=CC(=C4)C(=O)O)C

InChI

InChI=1S/C28H35N3O6/c1-5-35-24-14-19(15-25(36-6-2)26(24)28(34)37-7-3)17-30-12-10-21(11-13-30)31-18(4)29-22-16-20(27(32)33)8-9-23(22)31/h8-9,14-16,21H,5-7,10-13,17H2,1-4H3,(H,32,33)