Arenarone

Molecular Formula: C21H28O2


InChI: InChI=1/C21H28O2/c1-14-6-5-7-19-20(14,3)11-10-15(2)21(19,4)13-16-12-17(22)8-9-18(16)23/h8-9,12,15,19H,1,5-7,10-11,13H2,2-4H3/t15u,19-,20+,21-/m0/s1

InChIKey: InChIKey=NXIFNLNXFPAWTO-KWQCRQFBBJ
SMILES: CC1CCC2(C(C1(C)CC3=CC(=O)C=CC3=O)CCCC2=C)C

Names:
    Arenarone
    NSC613794
    2-[[(1S,4aS,8aR)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]cyclohexa-2,5-diene-1,4-dione
    87764-16-7

Registries:
    PubChem CID 5459099
    PubChem ID 8142006