2-(phenylmethyl)-1H-imidazole-4,5-dicarboxylic acid

Systemtic Name: 2-(phenylmethyl)-1H-imidazole-4,5-dicarboxylic acid Openeye Name: 2-benzyl-1H-imidazole-4,5-dicarboxylic acid CAS Name: 2-(phenylmethyl)-1H-imidazole-4,5-dicarboxylic acid IUPAC Name: 2-benzyl-1H-imidazole-4,5-dicarboxylic acid Traditional Name: 2-benzyl-1H-imidazole-4,5-dicarboxylic acid Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC(=C(N2)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC(=C(N2)C(=O)O)C(=O)O

InChI

InChI=1S/C12H10N2O4/c15-11(16)9-10(12(17)18)14-8(13-9)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,13,14)(H,15,16)(H,17,18)