5-propan-2-yl-3-propyl-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid

Systemtic Name: 5-propan-2-yl-3-propyl-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Openeye Name: 5-isopropyl-3-propyl-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid CAS Name: 5-propan-2-yl-3-propyl-1-[2-(trifluoromethyl)phenyl]-4-pyrazolecarboxylic acid IUPAC Name: 5-propan-2-yl-3-propyl-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Traditional Name: 5-isopropyl-3-propyl-1-[2-(trifluoromethyl)phenyl]pyrazole-4-carboxylic acid Formula: C17H19F3N2O2 MolecularWeight: 340.34017

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19F3N2O2/c1-4-7-12-14(16(23)24)15(10(2)3)22(21-12)13-9-6-5-8-11(13)17(18,19)20/h5-6,8-10H,4,7H2,1-3H3,(H,23,24)