[(3R)-2,2,4-trimethyl-3-oxidanyl-pentyl] nonanoate

Systemtic Name: [(3R)-2,2,4-trimethyl-3-oxidanyl-pentyl] nonanoate Openeye Name: [(3R)-3-hydroxy-2,2,4-trimethyl-pentyl] nonanoate CAS Name: nonanoic acid [(3R)-3-hydroxy-2,2,4-trimethylpentyl] ester IUPAC Name: [(3R)-3-hydroxy-2,2,4-trimethylpentyl] nonanoate Traditional Name: pelargonic acid [(3R)-3-hydroxy-2,2,4-trimethyl-pentyl] ester Formula: C17H34O3 MolecularWeight: 286.45006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OCC(C)(C)C(C(C)C)O

Isomeric SMILES

CCCCCCCCC(=O)OCC(C)(C)[C@@H](C(C)C)O

InChI

InChI=1S/C17H34O3/c1-6-7-8-9-10-11-12-15(18)20-13-17(4,5)16(19)14(2)3/h14,16,19H,6-13H2,1-5H3/t16-/m1/s1