4-[[5-(carboxymethyl)-4-chloranyl-imidazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[5-(carboxymethyl)-4-chloranyl-imidazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[5-(carboxymethyl)-4-chloro-imidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[5-(carboxymethyl)-4-chloro-1-imidazolyl]methyl]benzoic acid IUPAC Name: 4-[[5-(carboxymethyl)-4-chloroimidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[5-(carboxymethyl)-4-chloro-imidazol-1-yl]methyl]benzoic acid Formula: C13H11ClN2O4 MolecularWeight: 294.69044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC(=C2CC(=O)O)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC(=C2CC(=O)O)Cl)C(=O)O

InChI

InChI=1S/C13H11ClN2O4/c14-12-10(5-11(17)18)16(7-15-12)6-8-1-3-9(4-2-8)13(19)20/h1-4,7H,5-6H2,(H,17,18)(H,19,20)