3-(4,6-dimethylpyrimidin-2-yl)-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-(4,6-dimethylpyrimidin-2-yl)-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-(4,6-dimethylpyrimidin-2-yl)-4-oxo-phthalazine-1-carboxylate CAS Name: 3-(4,6-dimethyl-2-pyrimidinyl)-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-(4,6-dimethylpyrimidin-2-yl)-4-oxophthalazine-1-carboxylate Traditional Name: 3-(4,6-dimethylpyrimidin-2-yl)-4-keto-phthalazine-1-carboxylate Formula: C15H11N4O3- MolecularWeight: 295.27284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])C

InChI

InChI=1S/C15H12N4O3/c1-8-7-9(2)17-15(16-8)19-13(20)11-6-4-3-5-10(11)12(18-19)14(21)22/h3-7H,1-2H3,(H,21,22)/p-1