octan-3-yl 2-methylidene-3-oxidanyl-butanoate

Systemtic Name: octan-3-yl 2-methylidene-3-oxidanyl-butanoate Openeye Name: 1-ethylhexyl 3-hydroxy-2-methylene-butanoate CAS Name: 3-hydroxy-2-methylenebutanoic acid octan-3-yl ester IUPAC Name: octan-3-yl 3-hydroxy-2-methylidenebutanoate Traditional Name: 2-(1-hydroxyethyl)acrylic acid 1-ethylhexyl ester Formula: C13H24O3 MolecularWeight: 228.32786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C(=C)C(C)O

Isomeric SMILES

CCCCCC(CC)OC(=O)C(=C)C(C)O

InChI

InChI=1S/C13H24O3/c1-5-7-8-9-12(6-2)16-13(15)10(3)11(4)14/h11-12,14H,3,5-9H2,1-2,4H3