[(E)-3-phenylprop-2-enyl] 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Openeye Name: [(E)-cinnamyl] 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate CAS Name: 6-(1,2,4-triazol-1-yl)-3-pyridinecarboxylic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Traditional Name: 6-(1,2,4-triazol-1-yl)nicotinic acid [(E)-cinnamyl] ester Formula: C17H14N4O2 MolecularWeight: 306.31866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCOC(=O)C2=CN=C(C=C2)N3C=NC=N3

Isomeric SMILES

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

InChI

InChI=1S/C17H14N4O2/c22-17(23-10-4-7-14-5-2-1-3-6-14)15-8-9-16(19-11-15)21-13-18-12-20-21/h1-9,11-13H,10H2/b7-4+