[3-[bis(fluoranyl)methyl]-5-methyl-3-oxidanyl-1H-pyrazol-2-yl]-(4-butoxyphenyl)methanone

Systemtic Name: [3-[bis(fluoranyl)methyl]-5-methyl-3-oxidanyl-1H-pyrazol-2-yl]-(4-butoxyphenyl)methanone Openeye Name: (4-butoxyphenyl)-[3-(difluoromethyl)-3-hydroxy-5-methyl-1H-pyrazol-2-yl]methanone CAS Name: (4-butoxyphenyl)-[3-(difluoromethyl)-3-hydroxy-5-methyl-1H-pyrazol-2-yl]methanone IUPAC Name: (4-butoxyphenyl)-[3-(difluoromethyl)-3-hydroxy-5-methyl-1H-pyrazol-2-yl]methanone Traditional Name: (4-butoxyphenyl)-[5-(difluoromethyl)-5-hydroxy-3-methyl-3-pyrazolin-1-yl]methanone Formula: C16H20F2N2O3 MolecularWeight: 326.338406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2C(C=C(N2)C)(C(F)F)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2C(C=C(N2)C)(C(F)F)O

InChI

InChI=1S/C16H20F2N2O3/c1-3-4-9-23-13-7-5-12(6-8-13)14(21)20-16(22,15(17)18)10-11(2)19-20/h5-8,10,15,19,22H,3-4,9H2,1-2H3