ethyl 5-methyl-1-[8-(trifluoromethyl)quinolin-4-yl]-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[8-(trifluoromethyl)quinolin-4-yl]-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[8-(trifluoromethyl)-4-quinolyl]triazole-4-carboxylate CAS Name: 5-methyl-1-[8-(trifluoromethyl)-4-quinolinyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[8-(trifluoromethyl)quinolin-4-yl]triazole-4-carboxylate Traditional Name: 5-methyl-1-[8-(trifluoromethyl)-4-quinolyl]triazole-4-carboxylic acid ethyl ester Formula: C16H13F3N4O2 MolecularWeight: 350.29523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=C3C=CC=C(C3=NC=C2)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=C3C=CC=C(C3=NC=C2)C(F)(F)F)C

InChI

InChI=1S/C16H13F3N4O2/c1-3-25-15(24)13-9(2)23(22-21-13)12-7-8-20-14-10(12)5-4-6-11(14)16(17,18)19/h4-8H,3H2,1-2H3