ethyl (Z)-2-methyl-5-[(1S,2S)-2,4,4-trimethyl-6-oxidanylidene-cyclohexyl]pent-2-enoate

Systemtic Name: ethyl (Z)-2-methyl-5-[(1S,2S)-2,4,4-trimethyl-6-oxidanylidene-cyclohexyl]pent-2-enoate Openeye Name: ethyl (Z)-2-methyl-5-[(1S,2S)-2,4,4-trimethyl-6-oxo-cyclohexyl]pent-2-enoate CAS Name: (Z)-2-methyl-5-[(1S,2S)-2,4,4-trimethyl-6-oxocyclohexyl]-2-pentenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-methyl-5-[(1S,2S)-2,4,4-trimethyl-6-oxocyclohexyl]pent-2-enoate Traditional Name: (Z)-5-[(1S,6S)-2-keto-4,4,6-trimethyl-cyclohexyl]-2-methyl-pent-2-enoic acid ethyl ester Formula: C17H28O3 MolecularWeight: 280.40242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CCCC1C(CC(CC1=O)(C)C)C)C

Isomeric SMILES

CCOC(=O)/C(=C\CC[C@H]1[C@H](CC(CC1=O)(C)C)C)/C

InChI

InChI=1S/C17H28O3/c1-6-20-16(19)12(2)8-7-9-14-13(3)10-17(4,5)11-15(14)18/h8,13-14H,6-7,9-11H2,1-5H3/b12-8-/t13-,14-/m0/s1