[(2S)-1-[(3S,6R)-6-methyl-3-propan-2-yl-cyclohexen-1-yl]but-3-yn-2-yl] ethanoate

Systemtic Name: [(2S)-1-[(3S,6R)-6-methyl-3-propan-2-yl-cyclohexen-1-yl]but-3-yn-2-yl] ethanoate Openeye Name: [(1S)-1-[[(3S,6R)-3-isopropyl-6-methyl-cyclohexen-1-yl]methyl]prop-2-ynyl] acetate CAS Name: acetic acid [(2S)-1-[(3S,6R)-6-methyl-3-propan-2-yl-1-cyclohexenyl]but-3-yn-2-yl] ester IUPAC Name: [(2S)-1-[(3S,6R)-6-methyl-3-propan-2-ylcyclohexen-1-yl]but-3-yn-2-yl] acetate Traditional Name: acetic acid [(1S)-1-[[(3S,6R)-3-isopropyl-6-methyl-cyclohexen-1-yl]methyl]prop-2-ynyl] ester Formula: C16H24O2 MolecularWeight: 248.36056

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C=C1CC(C#C)OC(=O)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H](C=C1C[C@@H](C#C)OC(=O)C)C(C)C

InChI

InChI=1S/C16H24O2/c1-6-16(18-13(5)17)10-15-9-14(11(2)3)8-7-12(15)4/h1,9,11-12,14,16H,7-8,10H2,2-5H3/t12-,14-,16-/m1/s1