[2-ethyl-2-(hydroxymethyl)hexyl] 6-methylheptanoate

Systemtic Name: [2-ethyl-2-(hydroxymethyl)hexyl] 6-methylheptanoate Openeye Name: [2-ethyl-2-(hydroxymethyl)hexyl] 6-methylheptanoate CAS Name: 6-methylheptanoic acid [2-ethyl-2-(hydroxymethyl)hexyl] ester IUPAC Name: [2-ethyl-2-(hydroxymethyl)hexyl] 6-methylheptanoate Traditional Name: 6-methylenanthic acid (2-ethyl-2-methylol-hexyl) ester Formula: C17H34O3 MolecularWeight: 286.45006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(CO)COC(=O)CCCCC(C)C

Isomeric SMILES

CCCCC(CC)(CO)COC(=O)CCCCC(C)C

InChI

InChI=1S/C17H34O3/c1-5-7-12-17(6-2,13-18)14-20-16(19)11-9-8-10-15(3)4/h15,18H,5-14H2,1-4H3