2-[[(1R,2S,6R)-2-methoxy-6-oxidanyl-cyclohexyl]methyl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-[[(1R,2S,6R)-2-methoxy-6-oxidanyl-cyclohexyl]methyl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-[[(1R,2R,6S)-2-hydroxy-6-methoxy-cyclohexyl]methyl]-1,4-benzoquinone CAS Name: 2-[[(1R,2R,6S)-2-hydroxy-6-methoxycyclohexyl]methyl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-[[(1R,2R,6S)-2-hydroxy-6-methoxycyclohexyl]methyl]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2-[[(1R,2R,6S)-2-hydroxy-6-methoxy-cyclohexyl]methyl]-p-benzoquinone Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCCC(C1CC2=CC(=O)C=CC2=O)O

Isomeric SMILES

CO[C@H]1CCC[C@H]([C@H]1CC2=CC(=O)C=CC2=O)O

InChI

InChI=1S/C14H18O4/c1-18-14-4-2-3-13(17)11(14)8-9-7-10(15)5-6-12(9)16/h5-7,11,13-14,17H,2-4,8H2,1H3/t11-,13-,14+/m1/s1