2-butyl-5-chloranyl-3-[[6-(1-ethoxycarbonylcyclopentyl)pyridin-3-yl]methyl]imidazole-4-carboxylic acid

Systemtic Name: 2-butyl-5-chloranyl-3-[[6-(1-ethoxycarbonylcyclopentyl)pyridin-3-yl]methyl]imidazole-4-carboxylic acid Openeye Name: 2-butyl-5-chloro-3-[[6-(1-ethoxycarbonylcyclopentyl)-3-pyridyl]methyl]imidazole-4-carboxylic acid CAS Name: 2-butyl-5-chloro-3-[[6-(1-ethoxycarbonylcyclopentyl)-3-pyridinyl]methyl]-4-imidazolecarboxylic acid IUPAC Name: 2-butyl-5-chloro-3-[[6-(1-ethoxycarbonylcyclopentyl)pyridin-3-yl]methyl]imidazole-4-carboxylic acid Traditional Name: 2-butyl-3-[[6-(1-carbethoxycyclopentyl)-3-pyridyl]methyl]-5-chloro-imidazole-4-carboxylic acid Formula: C22H28ClN3O4 MolecularWeight: 433.92842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CN=C(C=C2)C3(CCCC3)C(=O)OCC)C(=O)O)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CN=C(C=C2)C3(CCCC3)C(=O)OCC)C(=O)O)Cl

InChI

InChI=1S/C22H28ClN3O4/c1-3-5-8-17-25-19(23)18(20(27)28)26(17)14-15-9-10-16(24-13-15)22(11-6-7-12-22)21(29)30-4-2/h9-10,13H,3-8,11-12,14H2,1-2H3,(H,27,28)