ethyl 3-oxidanylidene-6-(1,2,4-triazol-1-yl)hexanoate

Systemtic Name: ethyl 3-oxidanylidene-6-(1,2,4-triazol-1-yl)hexanoate Openeye Name: ethyl 3-oxo-6-(1,2,4-triazol-1-yl)hexanoate CAS Name: 3-oxo-6-(1,2,4-triazol-1-yl)hexanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-6-(1,2,4-triazol-1-yl)hexanoate Traditional Name: 3-keto-6-(1,2,4-triazol-1-yl)hexanoic acid ethyl ester Formula: C10H15N3O3 MolecularWeight: 225.2444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CCCN1C=NC=N1

Isomeric SMILES

CCOC(=O)CC(=O)CCCN1C=NC=N1

InChI

InChI=1S/C10H15N3O3/c1-2-16-10(15)6-9(14)4-3-5-13-8-11-7-12-13/h7-8H,2-6H2,1H3