[(2E,6E)-3,7,11,11-tetramethyl-4-oxidanyl-cycloundeca-2,6-dien-1-yl] ethanoate

Systemtic Name: [(2E,6E)-3,7,11,11-tetramethyl-4-oxidanyl-cycloundeca-2,6-dien-1-yl] ethanoate Openeye Name: [(2E,6E)-4-hydroxy-3,7,11,11-tetramethyl-cycloundeca-2,6-dien-1-yl] acetate CAS Name: acetic acid [(2E,6E)-4-hydroxy-3,7,11,11-tetramethyl-1-cycloundeca-2,6-dienyl] ester IUPAC Name: [(2E,6E)-4-hydroxy-3,7,11,11-tetramethylcycloundeca-2,6-dien-1-yl] acetate Traditional Name: acetic acid [(2E,6E)-4-hydroxy-3,7,11,11-tetramethyl-cycloundeca-2,6-dien-1-yl] ester Formula: C17H28O3 MolecularWeight: 280.40242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(=CC(C(CCC1)(C)C)OC(=O)C)C)O

Isomeric SMILES

C/C/1=C\CC(/C(=C/C(C(CCC1)(C)C)OC(=O)C)/C)O

InChI

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