methyl 2-[[6-oxidanylidene-3-phenyl-5-(trifluoromethyl)pyridazin-1-yl]methyl]furan-3-carboxylate

Systemtic Name: methyl 2-[[6-oxidanylidene-3-phenyl-5-(trifluoromethyl)pyridazin-1-yl]methyl]furan-3-carboxylate Openeye Name: methyl 2-[[6-oxo-3-phenyl-5-(trifluoromethyl)pyridazin-1-yl]methyl]furan-3-carboxylate CAS Name: 2-[[6-oxo-3-phenyl-5-(trifluoromethyl)-1-pyridazinyl]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[6-oxo-3-phenyl-5-(trifluoromethyl)pyridazin-1-yl]methyl]furan-3-carboxylate Traditional Name: 2-[[6-keto-3-phenyl-5-(trifluoromethyl)pyridazin-1-yl]methyl]furan-3-carboxylic acid methyl ester Formula: C18H13F3N2O4 MolecularWeight: 378.30203

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC=C1)CN2C(=O)C(=CC(=N2)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

COC(=O)C1=C(OC=C1)CN2C(=O)C(=CC(=N2)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H13F3N2O4/c1-26-17(25)12-7-8-27-15(12)10-23-16(24)13(18(19,20)21)9-14(22-23)11-5-3-2-4-6-11/h2-9H,10H2,1H3