2-methylbutyl 3-oxidanylheptanoate

Systemtic Name: 2-methylbutyl 3-oxidanylheptanoate Openeye Name: 2-methylbutyl 3-hydroxyheptanoate CAS Name: 3-hydroxyheptanoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 3-hydroxyheptanoate Traditional Name: 3-hydroxyenanthic acid 2-methylbutyl ester Formula: C12H24O3 MolecularWeight: 216.31716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)OCC(C)CC)O

Isomeric SMILES

CCCCC(CC(=O)OCC(C)CC)O

InChI

InChI=1S/C12H24O3/c1-4-6-7-11(13)8-12(14)15-9-10(3)5-2/h10-11,13H,4-9H2,1-3H3