5-[(3-methyl-2H-imidazol-1-yl)methyl]pyridine-2,3-dicarboxylic acid

Systemtic Name: 5-[(3-methyl-2H-imidazol-1-yl)methyl]pyridine-2,3-dicarboxylic acid Openeye Name: 5-[(3-methyl-2H-imidazol-1-yl)methyl]pyridine-2,3-dicarboxylic acid CAS Name: 5-[(3-methyl-2H-imidazol-1-yl)methyl]pyridine-2,3-dicarboxylic acid IUPAC Name: 5-[(3-methyl-2H-imidazol-1-yl)methyl]pyridine-2,3-dicarboxylic acid Traditional Name: 5-[(3-methyl-4-imidazolin-1-yl)methyl]quinolinic acid Formula: C12H13N3O4 MolecularWeight: 263.24932

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Descriptors Computed from Structure

Canonical SMILES:

CN1CN(C=C1)CC2=CN=C(C(=C2)C(=O)O)C(=O)O

Isomeric SMILES

CN1CN(C=C1)CC2=CN=C(C(=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C12H13N3O4/c1-14-2-3-15(7-14)6-8-4-9(11(16)17)10(12(18)19)13-5-8/h2-5H,6-7H2,1H3,(H,16,17)(H,18,19)