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

Systemtic Name: 2,3-bis(oxidanyl)propyl 2-propylpentanoate; 2-propylpentanoate Openeye Name: 2,3-dihydroxypropyl 2-propylpentanoate; 2-propylpentanoate CAS Name: 2-propylpentanoate; 2-propylpentanoic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl 2-propylpentanoate; 2-propylpentanoate Traditional Name: 2-propylvalerate; 2-propylvaleric acid glyceryl ester Formula: C27H52O8-2 MolecularWeight: 504.69698

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)OCC(CO)O

Isomeric SMILES

CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)OCC(CO)O

InChI

InChI=1S/C11H22O4.2C8H16O2/c1-3-5-9(6-4-2)11(14)15-8-10(13)7-12;2*1-3-5-7(6-4-2)8(9)10/h9-10,12-13H,3-8H2,1-2H3;2*7H,3-6H2,1-2H3,(H,9,10)/p-2