5-[3-(ethoxymethyl)-2,4,6-trimethyl-phenyl]-2-(1-oxidanylbutylidene)cyclohexane-1,3-dione

Systemtic Name: 5-[3-(ethoxymethyl)-2,4,6-trimethyl-phenyl]-2-(1-oxidanylbutylidene)cyclohexane-1,3-dione Openeye Name: 5-[3-(ethoxymethyl)-2,4,6-trimethyl-phenyl]-2-(1-hydroxybutylidene)cyclohexane-1,3-dione CAS Name: 5-[3-(ethoxymethyl)-2,4,6-trimethylphenyl]-2-(1-hydroxybutylidene)cyclohexane-1,3-dione IUPAC Name: 5-[3-(ethoxymethyl)-2,4,6-trimethylphenyl]-2-(1-hydroxybutylidene)cyclohexane-1,3-dione Traditional Name: 5-[3-(ethoxymethyl)-2,4,6-trimethyl-phenyl]-2-(1-hydroxybutylidene)cyclohexane-1,3-quinone Formula: C22H30O4 MolecularWeight: 358.4712

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C(=O)CC(CC1=O)C2=C(C(=C(C=C2C)C)COCC)C)O

Isomeric SMILES

CCCC(=C1C(=O)CC(CC1=O)C2=C(C(=C(C=C2C)C)COCC)C)O

InChI

InChI=1S/C22H30O4/c1-6-8-18(23)22-19(24)10-16(11-20(22)25)21-14(4)9-13(3)17(15(21)5)12-26-7-2/h9,16,23H,6-8,10-12H2,1-5H3