5,5-diethyl-3,3-dimethyl-6-(2-phenylethynyl)oxane-2,4-dione

Systemtic Name: 5,5-diethyl-3,3-dimethyl-6-(2-phenylethynyl)oxane-2,4-dione Openeye Name: 5,5-diethyl-3,3-dimethyl-6-(2-phenylethynyl)tetrahydropyran-2,4-dione CAS Name: 5,5-diethyl-3,3-dimethyl-6-(2-phenylethynyl)oxane-2,4-dione IUPAC Name: 5,5-diethyl-3,3-dimethyl-6-(2-phenylethynyl)oxane-2,4-dione Traditional Name: 5,5-diethyl-3,3-dimethyl-6-(2-phenylethynyl)tetrahydropyran-2,4-quinone Formula: C19H22O3 MolecularWeight: 298.37618

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(OC(=O)C(C1=O)(C)C)C#CC2=CC=CC=C2)CC

Isomeric SMILES

CCC1(C(OC(=O)C(C1=O)(C)C)C#CC2=CC=CC=C2)CC

InChI

InChI=1S/C19H22O3/c1-5-19(6-2)15(13-12-14-10-8-7-9-11-14)22-17(21)18(3,4)16(19)20/h7-11,15H,5-6H2,1-4H3