5-(2,6-dimethylphenyl)-2-(1-oxidanylpropylidene)cyclohexane-1,3-dione

Systemtic Name: 5-(2,6-dimethylphenyl)-2-(1-oxidanylpropylidene)cyclohexane-1,3-dione Openeye Name: 5-(2,6-dimethylphenyl)-2-(1-hydroxypropylidene)cyclohexane-1,3-dione CAS Name: 5-(2,6-dimethylphenyl)-2-(1-hydroxypropylidene)cyclohexane-1,3-dione IUPAC Name: 5-(2,6-dimethylphenyl)-2-(1-hydroxypropylidene)cyclohexane-1,3-dione Traditional Name: 5-(2,6-dimethylphenyl)-2-(1-hydroxypropylidene)cyclohexane-1,3-quinone Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20O3/c1-4-13(18)17-14(19)8-12(9-15(17)20)16-10(2)6-5-7-11(16)3/h5-7,12,18H,4,8-9H2,1-3H3