phenacyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate

Systemtic Name: phenacyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Openeye Name: phenacyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate CAS Name: 2-(1,2,4-triazol-1-yl)-3-pyridinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Traditional Name: 2-(1,2,4-triazol-1-yl)nicotinic acid phenacyl ester Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=C(N=CC=C2)N3C=NC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=C(N=CC=C2)N3C=NC=N3

InChI

InChI=1S/C16H12N4O3/c21-14(12-5-2-1-3-6-12)9-23-16(22)13-7-4-8-18-15(13)20-11-17-10-19-20/h1-8,10-11H,9H2