3-[(4-carboxy-2-chloranyl-phenyl)methyl]-2-methyl-benzimidazole-5-carboxylic acid

Systemtic Name: 3-[(4-carboxy-2-chloranyl-phenyl)methyl]-2-methyl-benzimidazole-5-carboxylic acid Openeye Name: 3-[(4-carboxy-2-chloro-phenyl)methyl]-2-methyl-benzimidazole-5-carboxylic acid CAS Name: 3-[(4-carboxy-2-chlorophenyl)methyl]-2-methyl-5-benzimidazolecarboxylic acid IUPAC Name: 3-[(4-carboxy-2-chlorophenyl)methyl]-2-methylbenzimidazole-5-carboxylic acid Traditional Name: 3-(4-carboxy-2-chloro-benzyl)-2-methyl-benzimidazole-5-carboxylic acid Formula: C17H13ClN2O4 MolecularWeight: 344.74912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=C(C=C(C=C3)C(=O)O)Cl)C=C(C=C2)C(=O)O

Isomeric SMILES

CC1=NC2=C(N1CC3=C(C=C(C=C3)C(=O)O)Cl)C=C(C=C2)C(=O)O

InChI

InChI=1S/C17H13ClN2O4/c1-9-19-14-5-4-11(17(23)24)7-15(14)20(9)8-12-3-2-10(16(21)22)6-13(12)18/h2-7H,8H2,1H3,(H,21,22)(H,23,24)