2-[(S)-(3-methoxy-4-oxidanyl-phenyl)-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]cyclohexane-1,3-dione

Systemtic Name: 2-[(S)-(3-methoxy-4-oxidanyl-phenyl)-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]cyclohexane-1,3-dione Openeye Name: 2-[(S)-(4-hydroxy-3-methoxy-phenyl)-(2-hydroxy-6-oxo-cyclohexen-1-yl)methyl]cyclohexane-1,3-dione CAS Name: 2-[(S)-(4-hydroxy-3-methoxyphenyl)-(2-hydroxy-6-oxo-1-cyclohexenyl)methyl]cyclohexane-1,3-dione IUPAC Name: 2-[(S)-(4-hydroxy-3-methoxyphenyl)-(2-hydroxy-6-oxocyclohexen-1-yl)methyl]cyclohexane-1,3-dione Traditional Name: 2-[(S)-(2-hydroxy-6-keto-cyclohexen-1-yl)-(4-hydroxy-3-methoxy-phenyl)methyl]cyclohexane-1,3-quinone Formula: C20H22O6 MolecularWeight: 358.38508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C2C(=O)CCCC2=O)C3=C(CCCC3=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)[C@H](C2C(=O)CCCC2=O)C3=C(CCCC3=O)O)O

InChI

InChI=1S/C20H22O6/c1-26-17-10-11(8-9-12(17)21)18(19-13(22)4-2-5-14(19)23)20-15(24)6-3-7-16(20)25/h8-10,18-19,21,24H,2-7H2,1H3/t18-/m1/s1