ethyl (2S)-5,6,6-trimethyl-2-oxidanyl-hepta-3,4-dienoate

Systemtic Name: ethyl (2S)-5,6,6-trimethyl-2-oxidanyl-hepta-3,4-dienoate Openeye Name: ethyl (2S)-2-hydroxy-5,6,6-trimethyl-hepta-3,4-dienoate CAS Name: (2S)-2-hydroxy-5,6,6-trimethylhepta-3,4-dienoic acid ethyl ester IUPAC Name: ethyl (2S)-2-hydroxy-5,6,6-trimethylhepta-3,4-dienoate Traditional Name: (2S)-2-hydroxy-5,6,6-trimethyl-hepta-3,4-dienoic acid ethyl ester Formula: C12H20O3 MolecularWeight: 212.2854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=C=C(C)C(C)(C)C)O

Isomeric SMILES

CCOC(=O)[C@H](C=C=C(C)C(C)(C)C)O

InChI

InChI=1S/C12H20O3/c1-6-15-11(14)10(13)8-7-9(2)12(3,4)5/h8,10,13H,6H2,1-5H3/t7?,10-/m0/s1