4-(2,6,6-trimethyl-3-oxidanyl-cyclohexen-1-yl)but-3-yn-2-yl ethanoate

Systemtic Name: 4-(2,6,6-trimethyl-3-oxidanyl-cyclohexen-1-yl)but-3-yn-2-yl ethanoate Openeye Name: [3-(3-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl)-1-methyl-prop-2-ynyl] acetate CAS Name: acetic acid 4-(3-hydroxy-2,6,6-trimethyl-1-cyclohexenyl)but-3-yn-2-yl ester IUPAC Name: 4-(3-hydroxy-2,6,6-trimethylcyclohexen-1-yl)but-3-yn-2-yl acetate Traditional Name: acetic acid [3-(3-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl)-1-methyl-prop-2-ynyl] ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1O)(C)C)C#CC(C)OC(=O)C

Isomeric SMILES

CC1=C(C(CCC1O)(C)C)C#CC(C)OC(=O)C

InChI

InChI=1S/C15H22O3/c1-10(18-12(3)16)6-7-13-11(2)14(17)8-9-15(13,4)5/h10,14,17H,8-9H2,1-5H3