[(E)-3,7,11,15,19-pentamethyl-19-oxidanyl-icos-5-en-8-yl] ethanoate

Systemtic Name: [(E)-3,7,11,15,19-pentamethyl-19-oxidanyl-icos-5-en-8-yl] ethanoate Openeye Name: [1-[(E)-1,5-dimethylhept-2-enyl]-12-hydroxy-4,8,12-trimethyl-tridecyl] acetate CAS Name: acetic acid [(E)-19-hydroxy-3,7,11,15,19-pentamethyleicos-5-en-8-yl] ester IUPAC Name: [(E)-19-hydroxy-3,7,11,15,19-pentamethylicos-5-en-8-yl] acetate Traditional Name: acetic acid [(E)-1-(11-hydroxy-3,7,11-trimethyl-dodecyl)-2,6-dimethyl-oct-3-enyl] ester Formula: C27H52O3 MolecularWeight: 424.69998

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC=CC(C)C(CCC(C)CCCC(C)CCCC(C)(C)O)OC(=O)C

Isomeric SMILES

CCC(C)C/C=C/C(C)C(CCC(C)CCCC(C)CCCC(C)(C)O)OC(=O)C

InChI

InChI=1S/C27H52O3/c1-9-21(2)13-11-17-24(5)26(30-25(6)28)19-18-23(4)15-10-14-22(3)16-12-20-27(7,8)29/h11,17,21-24,26,29H,9-10,12-16,18-20H2,1-8H3/b17-11+