[(1S)-3,5,5-trimethyl-4-[(E)-3-methyl-5-oxidanyl-pent-3-en-1-ynyl]-2-oxidanylidene-cyclohex-3-en-1-yl] ethanoate

Systemtic Name: [(1S)-3,5,5-trimethyl-4-[(E)-3-methyl-5-oxidanyl-pent-3-en-1-ynyl]-2-oxidanylidene-cyclohex-3-en-1-yl] ethanoate Openeye Name: [(1S)-4-[(E)-5-hydroxy-3-methyl-pent-3-en-1-ynyl]-3,5,5-trimethyl-2-oxo-cyclohex-3-en-1-yl] acetate CAS Name: acetic acid [(1S)-4-[(E)-5-hydroxy-3-methylpent-3-en-1-ynyl]-3,5,5-trimethyl-2-oxo-1-cyclohex-3-enyl] ester IUPAC Name: [(1S)-4-[(E)-5-hydroxy-3-methylpent-3-en-1-ynyl]-3,5,5-trimethyl-2-oxocyclohex-3-en-1-yl] acetate Traditional Name: acetic acid [(1S)-4-[(E)-5-hydroxy-3-methyl-pent-3-en-1-ynyl]-2-keto-3,5,5-trimethyl-cyclohex-3-en-1-yl] ester Formula: C17H22O4 MolecularWeight: 290.35418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(C1=O)OC(=O)C)(C)C)C#CC(=CCO)C

Isomeric SMILES

CC1=C(C(C[C@@H](C1=O)OC(=O)C)(C)C)C#C/C(=C/CO)/C

InChI

InChI=1S/C17H22O4/c1-11(8-9-18)6-7-14-12(2)16(20)15(21-13(3)19)10-17(14,4)5/h8,15,18H,9-10H2,1-5H3/b11-8+/t15-/m0/s1