(E)-4-[2,6,6-trimethyl-1,5-bis(oxidanyl)cyclohex-2-en-1-yl]but-3-en-2-one

Systemtic Name: (E)-4-[2,6,6-trimethyl-1,5-bis(oxidanyl)cyclohex-2-en-1-yl]but-3-en-2-one Openeye Name: (E)-4-(1,5-dihydroxy-2,6,6-trimethyl-cyclohex-2-en-1-yl)but-3-en-2-one CAS Name: (E)-4-(1,5-dihydroxy-2,6,6-trimethyl-1-cyclohex-2-enyl)-3-buten-2-one IUPAC Name: (E)-4-(1,5-dihydroxy-2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one Traditional Name: (E)-4-(1,5-dihydroxy-2,6,6-trimethyl-cyclohex-2-en-1-yl)but-3-en-2-one Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(C1(C=CC(=O)C)O)(C)C)O

Isomeric SMILES

CC1=CCC(C(C1(/C=C/C(=O)C)O)(C)C)O

InChI

InChI=1S/C13H20O3/c1-9-5-6-11(15)12(3,4)13(9,16)8-7-10(2)14/h5,7-8,11,15-16H,6H2,1-4H3/b8-7+