3,3,5-trimethyl-4-[(E)-3-methyl-5-oxidanyl-pent-3-en-1-ynyl]-2-oxidanyl-cyclohexan-1-one

Systemtic Name: 3,3,5-trimethyl-4-[(E)-3-methyl-5-oxidanyl-pent-3-en-1-ynyl]-2-oxidanyl-cyclohexan-1-one Openeye Name: 2-hydroxy-4-[(E)-5-hydroxy-3-methyl-pent-3-en-1-ynyl]-3,3,5-trimethyl-cyclohexanone CAS Name: 2-hydroxy-4-[(E)-5-hydroxy-3-methylpent-3-en-1-ynyl]-3,3,5-trimethyl-1-cyclohexanone IUPAC Name: 2-hydroxy-4-[(E)-5-hydroxy-3-methylpent-3-en-1-ynyl]-3,3,5-trimethylcyclohexan-1-one Traditional Name: 2-hydroxy-4-[(E)-5-hydroxy-3-methyl-pent-3-en-1-ynyl]-3,3,5-trimethyl-cyclohexanone Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C(C1C#CC(=CCO)C)(C)C)O

Isomeric SMILES

CC1CC(=O)C(C(C1C#C/C(=C/CO)/C)(C)C)O

InChI

InChI=1S/C15H22O3/c1-10(7-8-16)5-6-12-11(2)9-13(17)14(18)15(12,3)4/h7,11-12,14,16,18H,8-9H2,1-4H3/b10-7+