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

Systemtic Name: (4-butoxyphenyl)-[5-methyl-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone Openeye Name: (4-butoxyphenyl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone CAS Name: (4-butoxyphenyl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone IUPAC Name: (4-butoxyphenyl)-[3-hydroxy-5-methyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]methanone Traditional Name: (4-butoxyphenyl)-[5-hydroxy-3-methyl-5-(trifluoromethyl)-3-pyrazolin-1-yl]methanone Formula: C16H19F3N2O3 MolecularWeight: 344.32887

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19F3N2O3/c1-3-4-9-24-13-7-5-12(6-8-13)14(22)21-15(23,16(17,18)19)10-11(2)20-21/h5-8,10,20,23H,3-4,9H2,1-2H3