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

Systemtic Name: 3-[6-oxidanylidene-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexane-1-carboxylic acid Openeye Name: 3-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexanecarboxylic acid CAS Name: 3-[6-oxo-3-(2-phenyl-3-pyrazolo[1,5-a]pyridinyl)-1-pyridazinyl]-1-cyclohexanecarboxylic acid IUPAC Name: 3-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexane-1-carboxylic acid Traditional Name: 3-[6-keto-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]cyclohexanecarboxylic acid Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)N2C(=O)C=CC(=N2)C3=C4C=CC=CN4N=C3C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CC(CC(C1)N2C(=O)C=CC(=N2)C3=C4C=CC=CN4N=C3C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C24H22N4O3/c29-21-13-12-19(25-28(21)18-10-6-9-17(15-18)24(30)31)22-20-11-4-5-14-27(20)26-23(22)16-7-2-1-3-8-16/h1-5,7-8,11-14,17-18H,6,9-10,15H2,(H,30,31)