5-ethyl-3-hex-3-enyl-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid

Systemtic Name: 5-ethyl-3-hex-3-enyl-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Openeye Name: 5-ethyl-3-hex-3-enyl-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid CAS Name: 5-ethyl-3-hex-3-enyl-1-[2-(trifluoromethyl)phenyl]-4-pyrazolecarboxylic acid IUPAC Name: 5-ethyl-3-hex-3-enyl-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Traditional Name: 5-ethyl-3-hex-3-enyl-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Formula: C19H21F3N2O2 MolecularWeight: 366.37745

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCCC1=NN(C(=C1C(=O)O)CC)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCC=CCCC1=NN(C(=C1C(=O)O)CC)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C19H21F3N2O2/c1-3-5-6-7-11-14-17(18(25)26)15(4-2)24(23-14)16-12-9-8-10-13(16)19(20,21)22/h5-6,8-10,12H,3-4,7,11H2,1-2H3,(H,25,26)