4-[4-(4-methoxyphenoxy)-5-(trifluoromethyl)-1,2-dihydropyrazol-3-ylidene]-2-methyl-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-(4-methoxyphenoxy)-5-(trifluoromethyl)-1,2-dihydropyrazol-3-ylidene]-2-methyl-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 3-hydroxy-4-[4-(4-methoxyphenoxy)-5-(trifluoromethyl)-1,2-dihydropyrazol-3-ylidene]-2-methyl-cyclohexa-2,5-dien-1-one CAS Name: 3-hydroxy-4-[4-(4-methoxyphenoxy)-5-(trifluoromethyl)-1,2-dihydropyrazol-3-ylidene]-2-methyl-1-cyclohexa-2,5-dienone IUPAC Name: 3-hydroxy-4-[4-(4-methoxyphenoxy)-5-(trifluoromethyl)-1,2-dihydropyrazol-3-ylidene]-2-methylcyclohexa-2,5-dien-1-one Traditional Name: 3-hydroxy-4-[4-(4-methoxyphenoxy)-5-(trifluoromethyl)-3-pyrazolin-3-ylidene]-2-methyl-cyclohexa-2,5-dien-1-one Formula: C18H15F3N2O4 MolecularWeight: 380.31791

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C(NN2)C(F)(F)F)OC3=CC=C(C=C3)OC)C=CC1=O)O

Isomeric SMILES

CC1=C(C(=C2C(=C(NN2)C(F)(F)F)OC3=CC=C(C=C3)OC)C=CC1=O)O

InChI

InChI=1S/C18H15F3N2O4/c1-9-13(24)8-7-12(15(9)25)14-16(17(23-22-14)18(19,20)21)27-11-5-3-10(26-2)4-6-11/h3-8,22-23,25H,1-2H3