2-[3-(5-methyl-3-phenyl-pyrazol-1-yl)-6-oxidanylidene-pyridazin-1-yl]ethanoic acid

Systemtic Name: 2-[3-(5-methyl-3-phenyl-pyrazol-1-yl)-6-oxidanylidene-pyridazin-1-yl]ethanoic acid Openeye Name: 2-[3-(5-methyl-3-phenyl-pyrazol-1-yl)-6-oxo-pyridazin-1-yl]acetic acid CAS Name: 2-[3-(5-methyl-3-phenyl-1-pyrazolyl)-6-oxo-1-pyridazinyl]acetic acid IUPAC Name: 2-[3-(5-methyl-3-phenylpyrazol-1-yl)-6-oxopyridazin-1-yl]acetic acid Traditional Name: 2-[6-keto-3-(5-methyl-3-phenyl-pyrazol-1-yl)pyridazin-1-yl]acetic acid Formula: C16H14N4O3 MolecularWeight: 310.30736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN(C(=O)C=C2)CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NN1C2=NN(C(=O)C=C2)CC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C16H14N4O3/c1-11-9-13(12-5-3-2-4-6-12)17-20(11)14-7-8-15(21)19(18-14)10-16(22)23/h2-9H,10H2,1H3,(H,22,23)