2-(3-methylphenoxy)ethyl 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate

Systemtic Name: 2-(3-methylphenoxy)ethyl 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Openeye Name: 2-(3-methylphenoxy)ethyl 5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolecarboxylic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl 5-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxylic acid 2-(3-methylphenoxy)ethyl ester Formula: C20H18F3N3O3 MolecularWeight: 405.37043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCOC(=O)C2=C(N(N=C2)C3=NC=C(C=C3)C(F)(F)F)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCOC(=O)C2=C(N(N=C2)C3=NC=C(C=C3)C(F)(F)F)C

InChI

InChI=1S/C20H18F3N3O3/c1-13-4-3-5-16(10-13)28-8-9-29-19(27)17-12-25-26(14(17)2)18-7-6-15(11-24-18)20(21,22)23/h3-7,10-12H,8-9H2,1-2H3