propyl 4-oxidanyl-2-(1,2,4-triazol-1-ylmethyl)butanoate

Systemtic Name: propyl 4-oxidanyl-2-(1,2,4-triazol-1-ylmethyl)butanoate Openeye Name: propyl 4-hydroxy-2-(1,2,4-triazol-1-ylmethyl)butanoate CAS Name: 4-hydroxy-2-(1,2,4-triazol-1-ylmethyl)butanoic acid propyl ester IUPAC Name: propyl 4-hydroxy-2-(1,2,4-triazol-1-ylmethyl)butanoate Traditional Name: 4-hydroxy-2-(1,2,4-triazol-1-ylmethyl)butyric acid propyl ester Formula: C10H17N3O3 MolecularWeight: 227.26028

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(CCO)CN1C=NC=N1

Isomeric SMILES

CCCOC(=O)C(CCO)CN1C=NC=N1

InChI

InChI=1S/C10H17N3O3/c1-2-5-16-10(15)9(3-4-14)6-13-8-11-7-12-13/h7-9,14H,2-6H2,1H3