4-methyl-6-[2-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-methyl-6-[2-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-methyl-6-[2-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 4-methyl-6-[2-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-methyl-6-[2-phenyl-3-(trifluoromethyl)-1H-pyrazol-5-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-methyl-6-[1-phenyl-5-(trifluoromethyl)-3-pyrazolin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C17H13F3N2O MolecularWeight: 318.29313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(N(N2)C3=CC=CC=C3)C(F)(F)F)C(=O)C=C1

Isomeric SMILES

CC1=CC(=C2C=C(N(N2)C3=CC=CC=C3)C(F)(F)F)C(=O)C=C1

InChI

InChI=1S/C17H13F3N2O/c1-11-7-8-15(23)13(9-11)14-10-16(17(18,19)20)22(21-14)12-5-3-2-4-6-12/h2-10,21H,1H3