[5-(1,2-dioxiran-3-yl)-5-methyl-hexyl] pentanoate

Systemtic Name: [5-(1,2-dioxiran-3-yl)-5-methyl-hexyl] pentanoate Openeye Name: [5-(dioxiran-3-yl)-5-methyl-hexyl] pentanoate CAS Name: pentanoic acid [5-(3-dioxiranyl)-5-methylhexyl] ester IUPAC Name: [5-(dioxiran-3-yl)-5-methylhexyl] pentanoate Traditional Name: valeric acid [5-(dioxiran-3-yl)-5-methyl-hexyl] ester Formula: C13H24O4 MolecularWeight: 244.32726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCCCCC(C)(C)C1OO1

Isomeric SMILES

CCCCC(=O)OCCCCC(C)(C)C1OO1

InChI

InChI=1S/C13H24O4/c1-4-5-8-11(14)15-10-7-6-9-13(2,3)12-16-17-12/h12H,4-10H2,1-3H3