[5-[2,2-bis(hydroxymethyl)-3-oxidanyl-propoxy]-5-oxidanylidene-pentyl] 7-methyloctanoate

Systemtic Name: [5-[2,2-bis(hydroxymethyl)-3-oxidanyl-propoxy]-5-oxidanylidene-pentyl] 7-methyloctanoate Openeye Name: [5-[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]-5-oxo-pentyl] 7-methyloctanoate CAS Name: 7-methyloctanoic acid [5-[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]-5-oxopentyl] ester IUPAC Name: [5-[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]-5-oxopentyl] 7-methyloctanoate Traditional Name: 7-methylcaprylic acid [5-(3-hydroxy-2,2-dimethylol-propoxy)-5-keto-pentyl] ester Formula: C19H36O7 MolecularWeight: 376.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC(=O)OCCCCC(=O)OCC(CO)(CO)CO

Isomeric SMILES

CC(C)CCCCCC(=O)OCCCCC(=O)OCC(CO)(CO)CO

InChI

InChI=1S/C19H36O7/c1-16(2)8-4-3-5-9-17(23)25-11-7-6-10-18(24)26-15-19(12-20,13-21)14-22/h16,20-22H,3-15H2,1-2H3