5-(2,6-dimethyl-4-oxidanyl-phenyl)-2-(1-oxidanylpropylidene)cyclohexane-1,3-dione

Systemtic Name: 5-(2,6-dimethyl-4-oxidanyl-phenyl)-2-(1-oxidanylpropylidene)cyclohexane-1,3-dione Openeye Name: 5-(4-hydroxy-2,6-dimethyl-phenyl)-2-(1-hydroxypropylidene)cyclohexane-1,3-dione CAS Name: 5-(4-hydroxy-2,6-dimethylphenyl)-2-(1-hydroxypropylidene)cyclohexane-1,3-dione IUPAC Name: 5-(4-hydroxy-2,6-dimethylphenyl)-2-(1-hydroxypropylidene)cyclohexane-1,3-dione Traditional Name: 5-(4-hydroxy-2,6-dimethyl-phenyl)-2-(1-hydroxypropylidene)cyclohexane-1,3-quinone Formula: C17H20O4 MolecularWeight: 288.3383

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)O)C)O

Isomeric SMILES

CCC(=C1C(=O)CC(CC1=O)C2=C(C=C(C=C2C)O)C)O

InChI

InChI=1S/C17H20O4/c1-4-13(19)17-14(20)7-11(8-15(17)21)16-9(2)5-12(18)6-10(16)3/h5-6,11,18-19H,4,7-8H2,1-3H3