ethyl 4-(5-pyridin-4-yl-4,5-dihydro-1,2,3-triazol-1-yl)benzoate

Systemtic Name: ethyl 4-(5-pyridin-4-yl-4,5-dihydro-1,2,3-triazol-1-yl)benzoate Openeye Name: ethyl 4-[5-(4-pyridyl)-4,5-dihydrotriazol-1-yl]benzoate CAS Name: 4-(5-pyridin-4-yl-4,5-dihydrotriazol-1-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(5-pyridin-4-yl-4,5-dihydrotriazol-1-yl)benzoate Traditional Name: 4-[5-(4-pyridyl)-4,5-dihydrotriazol-1-yl]benzoic acid ethyl ester Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(CN=N2)C3=CC=NC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(CN=N2)C3=CC=NC=C3

InChI

InChI=1S/C16H16N4O2/c1-2-22-16(21)13-3-5-14(6-4-13)20-15(11-18-19-20)12-7-9-17-10-8-12/h3-10,15H,2,11H2,1H3