4-chloranyl-1-cyclohexa-2,4-dien-1-yl-5-(4-methylphenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 4-chloranyl-1-cyclohexa-2,4-dien-1-yl-5-(4-methylphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 4-chloro-1-cyclohexa-2,4-dien-1-yl-5-(p-tolyl)-3-(trifluoromethyl)pyrazole CAS Name: 4-chloro-1-(1-cyclohexa-2,4-dienyl)-5-(4-methylphenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 4-chloro-1-cyclohexa-2,4-dien-1-yl-5-(4-methylphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 4-chloro-1-cyclohexa-2,4-dien-1-yl-5-(p-tolyl)-3-(trifluoromethyl)pyrazole Formula: C17H14ClF3N2 MolecularWeight: 338.75467

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NN2C3CC=CC=C3)C(F)(F)F)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NN2C3CC=CC=C3)C(F)(F)F)Cl

InChI

InChI=1S/C17H14ClF3N2/c1-11-7-9-12(10-8-11)15-14(18)16(17(19,20)21)22-23(15)13-5-3-2-4-6-13/h2-5,7-10,13H,6H2,1H3