3-[(4-carboxyphenyl)methyl]-2-ethoxy-benzimidazole-5-carboxylic acid

Systemtic Name: 3-[(4-carboxyphenyl)methyl]-2-ethoxy-benzimidazole-5-carboxylic acid Openeye Name: 3-[(4-carboxyphenyl)methyl]-2-ethoxy-benzimidazole-5-carboxylic acid CAS Name: 3-[(4-carboxyphenyl)methyl]-2-ethoxy-5-benzimidazolecarboxylic acid IUPAC Name: 3-[(4-carboxyphenyl)methyl]-2-ethoxybenzimidazole-5-carboxylic acid Traditional Name: 3-(4-carboxybenzyl)-2-ethoxy-benzimidazole-5-carboxylic acid Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)O)C=C(C=C2)C(=O)O

Isomeric SMILES

CCOC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)O)C=C(C=C2)C(=O)O

InChI

InChI=1S/C18H16N2O5/c1-2-25-18-19-14-8-7-13(17(23)24)9-15(14)20(18)10-11-3-5-12(6-4-11)16(21)22/h3-9H,2,10H2,1H3,(H,21,22)(H,23,24)