[(E)-3-phenylprop-2-enyl] 4-(1,2,4-triazol-1-yl)benzoate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 4-(1,2,4-triazol-1-yl)benzoate Openeye Name: [(E)-cinnamyl] 4-(1,2,4-triazol-1-yl)benzoate CAS Name: 4-(1,2,4-triazol-1-yl)benzoic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 4-(1,2,4-triazol-1-yl)benzoic acid [(E)-cinnamyl] ester Formula: C18H15N3O2 MolecularWeight: 305.3306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N3O2/c22-18(23-12-4-7-15-5-2-1-3-6-15)16-8-10-17(11-9-16)21-14-19-13-20-21/h1-11,13-14H,12H2/b7-4+