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

Systemtic Name: ethyl 5-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-methyl-benzotriazole-1-carboxylate Openeye Name: ethyl 5-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-methyl-benzotriazole-1-carboxylate CAS Name: 5-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-methyl-1-benzotriazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-methylbenzotriazole-1-carboxylate Traditional Name: 5-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-methyl-benzotriazole-1-carboxylic acid ethyl ester Formula: C16H12ClF3N4O2 MolecularWeight: 384.74029

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=C(C(=C(C=C2)C3=C(C=C(C=N3)C(F)(F)F)Cl)C)N=N1

Isomeric SMILES

CCOC(=O)N1C2=C(C(=C(C=C2)C3=C(C=C(C=N3)C(F)(F)F)Cl)C)N=N1

InChI

InChI=1S/C16H12ClF3N4O2/c1-3-26-15(25)24-12-5-4-10(8(2)13(12)22-23-24)14-11(17)6-9(7-21-14)16(18,19)20/h4-7H,3H2,1-2H3