ethyl 5-(chloromethyl)-1-(2-pyridin-2-ylcarbonylphenyl)-1,2,4-triazole-3-carboxylate

Systemtic Name: ethyl 5-(chloromethyl)-1-(2-pyridin-2-ylcarbonylphenyl)-1,2,4-triazole-3-carboxylate Openeye Name: ethyl 5-(chloromethyl)-1-[2-(pyridine-2-carbonyl)phenyl]-1,2,4-triazole-3-carboxylate CAS Name: 5-(chloromethyl)-1-[2-[oxo(2-pyridinyl)methyl]phenyl]-1,2,4-triazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(chloromethyl)-1-[2-(pyridine-2-carbonyl)phenyl]-1,2,4-triazole-3-carboxylate Traditional Name: 5-(chloromethyl)-1-(2-picolinoylphenyl)-1,2,4-triazole-3-carboxylic acid ethyl ester Formula: C18H15ClN4O3 MolecularWeight: 370.7897

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=N1)CCl)C2=CC=CC=C2C(=O)C3=CC=CC=N3

Isomeric SMILES

CCOC(=O)C1=NN(C(=N1)CCl)C2=CC=CC=C2C(=O)C3=CC=CC=N3

InChI

InChI=1S/C18H15ClN4O3/c1-2-26-18(25)17-21-15(11-19)23(22-17)14-9-4-3-7-12(14)16(24)13-8-5-6-10-20-13/h3-10H,2,11H2,1H3