3-[(1-methylimidazol-2-yl)methyl]-4-oxidanylidene-phthalazine-1-carboxylic acid

Systemtic Name: 3-[(1-methylimidazol-2-yl)methyl]-4-oxidanylidene-phthalazine-1-carboxylic acid Openeye Name: 3-[(1-methylimidazol-2-yl)methyl]-4-oxo-phthalazine-1-carboxylic acid CAS Name: 3-[(1-methyl-2-imidazolyl)methyl]-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-[(1-methylimidazol-2-yl)methyl]-4-oxophthalazine-1-carboxylic acid Traditional Name: 4-keto-3-[(1-methylimidazol-2-yl)methyl]phthalazine-1-carboxylic acid Formula: C14H12N4O3 MolecularWeight: 284.27008

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

Isomeric SMILES

CN1C=CN=C1CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI

InChI=1S/C14H12N4O3/c1-17-7-6-15-11(17)8-18-13(19)10-5-3-2-4-9(10)12(16-18)14(20)21/h2-7H,8H2,1H3,(H,20,21)