3,3-diethyl-7-[5-ethyl-5-(hydroxymethyl)heptoxy]heptanoic acid

Systemtic Name: 3,3-diethyl-7-[5-ethyl-5-(hydroxymethyl)heptoxy]heptanoic acid Openeye Name: 3,3-diethyl-7-[5-ethyl-5-(hydroxymethyl)heptoxy]heptanoic acid CAS Name: 3,3-diethyl-7-[5-ethyl-5-(hydroxymethyl)heptoxy]heptanoic acid IUPAC Name: 3,3-diethyl-7-[5-ethyl-5-(hydroxymethyl)heptoxy]heptanoic acid Traditional Name: 3,3-diethyl-7-(5-ethyl-5-methylol-heptoxy)enanthic acid Formula: C21H42O4 MolecularWeight: 358.55578

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCCCOCCCCC(CC)(CC)CO)CC(=O)O

Isomeric SMILES

CCC(CC)(CCCCOCCCCC(CC)(CC)CO)CC(=O)O

InChI

InChI=1S/C21H42O4/c1-5-20(6-2,17-19(23)24)13-9-11-15-25-16-12-10-14-21(7-3,8-4)18-22/h22H,5-18H2,1-4H3,(H,23,24)