2-chloranylprop-2-enyl 5-phenyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylate

Systemtic Name: 2-chloranylprop-2-enyl 5-phenyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylate Openeye Name: 2-chloroallyl 5-phenyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylate CAS Name: 5-phenyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylic acid 2-chloroprop-2-enyl ester IUPAC Name: 2-chloroprop-2-enyl 5-phenyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylate Traditional Name: 5-phenyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylic acid 2-chloroallyl ester Formula: C19H13ClF3N3O2 MolecularWeight: 407.77363

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Descriptors Computed from Structure

Canonical SMILES:

C=C(COC(=O)C1=NN(C(=N1)C2=CC=CC=C2)C3=CC=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

C=C(COC(=O)C1=NN(C(=N1)C2=CC=CC=C2)C3=CC=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C19H13ClF3N3O2/c1-12(20)11-28-18(27)16-24-17(13-6-3-2-4-7-13)26(25-16)15-9-5-8-14(10-15)19(21,22)23/h2-10H,1,11H2