2-(3,7-dimethyl-4-oxidanylidene-2-phenyl-pyrazolo[3,4-d]pyridazin-5-yl)ethanoic acid

Systemtic Name: 2-(3,7-dimethyl-4-oxidanylidene-2-phenyl-pyrazolo[3,4-d]pyridazin-5-yl)ethanoic acid Openeye Name: 2-(3,7-dimethyl-4-oxo-2-phenyl-pyrazolo[3,4-d]pyridazin-5-yl)acetic acid CAS Name: 2-(3,7-dimethyl-4-oxo-2-phenyl-5-pyrazolo[3,4-d]pyridazinyl)acetic acid IUPAC Name: 2-(3,7-dimethyl-4-oxo-2-phenylpyrazolo[3,4-d]pyridazin-5-yl)acetic acid Traditional Name: 2-(4-keto-3,7-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazin-5-yl)acetic acid Formula: C15H14N4O3 MolecularWeight: 298.29666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN1C3=CC=CC=C3)C(=NN(C2=O)CC(=O)O)C

Isomeric SMILES

CC1=C2C(=NN1C3=CC=CC=C3)C(=NN(C2=O)CC(=O)O)C

InChI

InChI=1S/C15H14N4O3/c1-9-14-13(15(22)18(16-9)8-12(20)21)10(2)19(17-14)11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,20,21)