2-methyl-3-[6-oxidanylidene-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]propanoic acid

Systemtic Name: 2-methyl-3-[6-oxidanylidene-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]propanoic acid Openeye Name: 2-methyl-3-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]propanoic acid CAS Name: 2-methyl-3-[6-oxo-3-(2-phenyl-3-pyrazolo[1,5-a]pyridinyl)-1-pyridazinyl]propanoic acid IUPAC Name: 2-methyl-3-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]propanoic acid Traditional Name: 3-[6-keto-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]-2-methyl-propionic acid Formula: C21H18N4O3 MolecularWeight: 374.39262

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)C=CC(=N1)C2=C3C=CC=CN3N=C2C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(CN1C(=O)C=CC(=N1)C2=C3C=CC=CN3N=C2C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C21H18N4O3/c1-14(21(27)28)13-25-18(26)11-10-16(22-25)19-17-9-5-6-12-24(17)23-20(19)15-7-3-2-4-8-15/h2-12,14H,13H2,1H3,(H,27,28)