[(1R)-3,5,5-trimethyl-4-[(3S)-3-oxidanylbut-1-ynyl]cyclohex-3-en-1-yl] ethanoate

Systemtic Name: [(1R)-3,5,5-trimethyl-4-[(3S)-3-oxidanylbut-1-ynyl]cyclohex-3-en-1-yl] ethanoate Openeye Name: [(1R)-4-[(3S)-3-hydroxybut-1-ynyl]-3,5,5-trimethyl-cyclohex-3-en-1-yl] acetate CAS Name: acetic acid [(1R)-4-[(3S)-3-hydroxybut-1-ynyl]-3,5,5-trimethyl-1-cyclohex-3-enyl] ester IUPAC Name: [(1R)-4-[(3S)-3-hydroxybut-1-ynyl]-3,5,5-trimethylcyclohex-3-en-1-yl] acetate Traditional Name: acetic acid [(1R)-4-[(3S)-3-hydroxybut-1-ynyl]-3,5,5-trimethyl-cyclohex-3-en-1-yl] ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22O3/c1-10-8-13(18-12(3)17)9-15(4,5)14(10)7-6-11(2)16/h11,13,16H,8-9H2,1-5H3/t11-,13+/m0/s1