ethyl (2Z,4Z,8E)-2-ethyl-5,9,13-trimethyl-13-oxidanyl-tetradeca-2,4,8-trienoate

Systemtic Name: ethyl (2Z,4Z,8E)-2-ethyl-5,9,13-trimethyl-13-oxidanyl-tetradeca-2,4,8-trienoate Openeye Name: ethyl (2Z,4Z,8E)-2-ethyl-13-hydroxy-5,9,13-trimethyl-tetradeca-2,4,8-trienoate CAS Name: (2Z,4Z,8E)-2-ethyl-13-hydroxy-5,9,13-trimethyltetradeca-2,4,8-trienoic acid ethyl ester IUPAC Name: ethyl (2Z,4Z,8E)-2-ethyl-13-hydroxy-5,9,13-trimethyltetradeca-2,4,8-trienoate Traditional Name: (2Z,4Z,8E)-2-ethyl-13-hydroxy-5,9,13-trimethyl-tetradeca-2,4,8-trienoic acid ethyl ester Formula: C21H36O3 MolecularWeight: 336.50874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC/C(=C/C=C(/C)\CC/C=C(\C)/CCCC(C)(C)O)/C(=O)OCC

InChI

InChI=1S/C21H36O3/c1-7-19(20(22)24-8-2)15-14-18(4)12-9-11-17(3)13-10-16-21(5,6)23/h11,14-15,23H,7-10,12-13,16H2,1-6H3/b17-11+,18-14-,19-15-