propyl 4-prop-2-enoxycarbonyloxy-2-(1,2,4-triazol-1-ylmethyl)butanoate

Systemtic Name: propyl 4-prop-2-enoxycarbonyloxy-2-(1,2,4-triazol-1-ylmethyl)butanoate Openeye Name: propyl 4-allyloxycarbonyloxy-2-(1,2,4-triazol-1-ylmethyl)butanoate CAS Name: 4-[oxo(prop-2-enoxy)methoxy]-2-(1,2,4-triazol-1-ylmethyl)butanoic acid propyl ester IUPAC Name: propyl 4-prop-2-enoxycarbonyloxy-2-(1,2,4-triazol-1-ylmethyl)butanoate Traditional Name: 4-allyloxycarbonyloxy-2-(1,2,4-triazol-1-ylmethyl)butyric acid propyl ester Formula: C14H21N3O5 MolecularWeight: 311.33364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O5/c1-3-6-20-13(18)12(9-17-11-15-10-16-17)5-8-22-14(19)21-7-4-2/h4,10-12H,2-3,5-9H2,1H3