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

Systemtic Name: propyl 4-acetyloxy-2-(1,2,4-triazol-1-ylmethyl)butanoate Openeye Name: propyl 4-acetoxy-2-(1,2,4-triazol-1-ylmethyl)butanoate CAS Name: 4-acetyloxy-2-(1,2,4-triazol-1-ylmethyl)butanoic acid propyl ester IUPAC Name: propyl 4-acetyloxy-2-(1,2,4-triazol-1-ylmethyl)butanoate Traditional Name: 4-acetoxy-2-(1,2,4-triazol-1-ylmethyl)butyric acid propyl ester Formula: C12H19N3O4 MolecularWeight: 269.29696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N3O4/c1-3-5-19-12(17)11(4-6-18-10(2)16)7-15-9-13-8-14-15/h8-9,11H,3-7H2,1-2H3