2-(4-propanoylphenoxy)-N-(1H-1,2,4-triazol-5-yl)ethanimidate

Systemtic Name: 2-(4-propanoylphenoxy)-N-(1H-1,2,4-triazol-5-yl)ethanimidate Openeye Name: 2-(4-propanoylphenoxy)-N-(1H-1,2,4-triazol-5-yl)ethanimidate CAS Name: 2-[4-(1-oxopropyl)phenoxy]-N-(1H-1,2,4-triazol-5-yl)ethanimidate IUPAC Name: 2-(4-propanoylphenoxy)-N-(1H-1,2,4-triazol-5-yl)ethanimidate Traditional Name: 2-(4-propionylphenoxy)-N-(1H-1,2,4-triazol-5-yl)acetimidate Formula: C13H13N4O3- MolecularWeight: 273.26732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(=NC2=NC=NN2)[O-]

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(=NC2=NC=NN2)[O-]

InChI

InChI=1S/C13H14N4O3/c1-2-11(18)9-3-5-10(6-4-9)20-7-12(19)16-13-14-8-15-17-13/h3-6,8H,2,7H2,1H3,(H2,14,15,16,17,19)/p-1