2,3-bis(oxidanyl)propyl hexanoate; hexanoate

Systemtic Name: 2,3-bis(oxidanyl)propyl hexanoate; hexanoate Openeye Name: 2,3-dihydroxypropyl hexanoate; hexanoate CAS Name: hexanoate; hexanoic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl hexanoate; hexanoate Traditional Name: hexanoate; hexanoic acid glyceryl ester Formula: C21H40O8-2 MolecularWeight: 420.5375

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)[O-].CCCCCC(=O)[O-].CCCCCC(=O)OCC(CO)O

Isomeric SMILES

CCCCCC(=O)[O-].CCCCCC(=O)[O-].CCCCCC(=O)OCC(CO)O

InChI

InChI=1S/C9H18O4.2C6H12O2/c1-2-3-4-5-9(12)13-7-8(11)6-10;2*1-2-3-4-5-6(7)8/h8,10-11H,2-7H2,1H3;2*2-5H2,1H3,(H,7,8)/p-2