4-[[2-(4-fluorophenyl)-5-methyl-6-(2-methyl-1,3-dioxolan-2-yl)-3-oxidanylidene-pyridazin-4-yl]oxymethyl]pyridine-2-carbonitrile

Systemtic Name: 4-[[2-(4-fluorophenyl)-5-methyl-6-(2-methyl-1,3-dioxolan-2-yl)-3-oxidanylidene-pyridazin-4-yl]oxymethyl]pyridine-2-carbonitrile Openeye Name: 4-[[2-(4-fluorophenyl)-5-methyl-6-(2-methyl-1,3-dioxolan-2-yl)-3-oxo-pyridazin-4-yl]oxymethyl]pyridine-2-carbonitrile CAS Name: 4-[[2-(4-fluorophenyl)-5-methyl-6-(2-methyl-1,3-dioxolan-2-yl)-3-oxo-4-pyridazinyl]oxymethyl]-2-pyridinecarbonitrile IUPAC Name: 4-[[2-(4-fluorophenyl)-5-methyl-6-(2-methyl-1,3-dioxolan-2-yl)-3-oxopyridazin-4-yl]oxymethyl]pyridine-2-carbonitrile Traditional Name: 4-[[2-(4-fluorophenyl)-3-keto-5-methyl-6-(2-methyl-1,3-dioxolan-2-yl)pyridazin-4-yl]oxymethyl]picolinonitrile Formula: C22H19FN4O4 MolecularWeight: 422.409063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C2(OCCO2)C)C3=CC=C(C=C3)F)OCC4=CC(=NC=C4)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C2(OCCO2)C)C3=CC=C(C=C3)F)OCC4=CC(=NC=C4)C#N

InChI

InChI=1S/C22H19FN4O4/c1-14-19(29-13-15-7-8-25-17(11-15)12-24)21(28)27(18-5-3-16(23)4-6-18)26-20(14)22(2)30-9-10-31-22/h3-8,11H,9-10,13H2,1-2H3