1,2-dioxetan-3-yl 2-butyl-3,3-dimethyl-5-oxidanyl-hexanoate

Systemtic Name: 1,2-dioxetan-3-yl 2-butyl-3,3-dimethyl-5-oxidanyl-hexanoate Openeye Name: dioxetan-3-yl 2-butyl-5-hydroxy-3,3-dimethyl-hexanoate CAS Name: 2-butyl-5-hydroxy-3,3-dimethylhexanoic acid 3-dioxetanyl ester IUPAC Name: dioxetan-3-yl 2-butyl-5-hydroxy-3,3-dimethylhexanoate Traditional Name: 2-butyl-5-hydroxy-3,3-dimethyl-hexanoic acid dioxetan-3-yl ester Formula: C14H26O5 MolecularWeight: 274.35324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC1COO1)C(C)(C)CC(C)O

Isomeric SMILES

CCCCC(C(=O)OC1COO1)C(C)(C)CC(C)O

InChI

InChI=1S/C14H26O5/c1-5-6-7-11(14(3,4)8-10(2)15)13(16)18-12-9-17-19-12/h10-12,15H,5-9H2,1-4H3