2-(2-methylimidazol-1-yl)carbonylterephthalic acid

Systemtic Name: 2-(2-methylimidazol-1-yl)carbonylterephthalic acid Openeye Name: 2-(2-methylimidazole-1-carbonyl)terephthalic acid CAS Name: 2-[(2-methyl-1-imidazolyl)-oxomethyl]terephthalic acid IUPAC Name: 2-(2-methylimidazole-1-carbonyl)terephthalic acid Traditional Name: 2-(2-methylimidazole-1-carbonyl)terephthalic acid Formula: C13H10N2O5 MolecularWeight: 274.2289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C(=O)C2=C(C=CC(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC1=NC=CN1C(=O)C2=C(C=CC(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C13H10N2O5/c1-7-14-4-5-15(7)11(16)10-6-8(12(17)18)2-3-9(10)13(19)20/h2-6H,1H3,(H,17,18)(H,19,20)