ethyl 2-(1,2,4-triazol-1-yl)hexanoate

Systemtic Name: ethyl 2-(1,2,4-triazol-1-yl)hexanoate Openeye Name: ethyl 2-(1,2,4-triazol-1-yl)hexanoate CAS Name: 2-(1,2,4-triazol-1-yl)hexanoic acid ethyl ester IUPAC Name: ethyl 2-(1,2,4-triazol-1-yl)hexanoate Traditional Name: 2-(1,2,4-triazol-1-yl)hexanoic acid ethyl ester Formula: C10H17N3O2 MolecularWeight: 211.26088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)N1C=NC=N1

Isomeric SMILES

CCCCC(C(=O)OCC)N1C=NC=N1

InChI

InChI=1S/C10H17N3O2/c1-3-5-6-9(10(14)15-4-2)13-8-11-7-12-13/h7-9H,3-6H2,1-2H3