5-[(3,5-dimethylphenyl)methyl]-6-(ethoxymethyl)-4-ethyl-cyclohex-4-ene-1,3-dione

Systemtic Name: 5-[(3,5-dimethylphenyl)methyl]-6-(ethoxymethyl)-4-ethyl-cyclohex-4-ene-1,3-dione Openeye Name: 5-[(3,5-dimethylphenyl)methyl]-6-(ethoxymethyl)-4-ethyl-cyclohex-4-ene-1,3-dione CAS Name: 5-[(3,5-dimethylphenyl)methyl]-6-(ethoxymethyl)-4-ethylcyclohex-4-ene-1,3-dione IUPAC Name: 5-[(3,5-dimethylphenyl)methyl]-6-(ethoxymethyl)-4-ethylcyclohex-4-ene-1,3-dione Traditional Name: 5-(3,5-dimethylbenzyl)-6-(ethoxymethyl)-4-ethyl-cyclohex-4-ene-1,3-quinone Formula: C20H26O3 MolecularWeight: 314.41864

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C(=O)CC1=O)COCC)CC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCC1=C(C(C(=O)CC1=O)COCC)CC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C20H26O3/c1-5-16-17(10-15-8-13(3)7-14(4)9-15)18(12-23-6-2)20(22)11-19(16)21/h7-9,18H,5-6,10-12H2,1-4H3