5-[1-(5,5-dimethyl-1,3-dioxan-2-yl)propyl]-4-oxidanyl-4-(2-phenylethynyl)cyclohex-2-en-1-one

Systemtic Name: 5-[1-(5,5-dimethyl-1,3-dioxan-2-yl)propyl]-4-oxidanyl-4-(2-phenylethynyl)cyclohex-2-en-1-one Openeye Name: 5-[1-(5,5-dimethyl-1,3-dioxan-2-yl)propyl]-4-hydroxy-4-(2-phenylethynyl)cyclohex-2-en-1-one CAS Name: 5-[1-(5,5-dimethyl-1,3-dioxan-2-yl)propyl]-4-hydroxy-4-(2-phenylethynyl)-1-cyclohex-2-enone IUPAC Name: 5-[1-(5,5-dimethyl-1,3-dioxan-2-yl)propyl]-4-hydroxy-4-(2-phenylethynyl)cyclohex-2-en-1-one Traditional Name: 5-[1-(5,5-dimethyl-1,3-dioxan-2-yl)propyl]-4-hydroxy-4-(2-phenylethynyl)cyclohex-2-en-1-one Formula: C23H28O4 MolecularWeight: 368.46602

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CC(=O)C=CC1(C#CC2=CC=CC=C2)O)C3OCC(CO3)(C)C

Isomeric SMILES

CCC(C1CC(=O)C=CC1(C#CC2=CC=CC=C2)O)C3OCC(CO3)(C)C

InChI

InChI=1S/C23H28O4/c1-4-19(21-26-15-22(2,3)16-27-21)20-14-18(24)11-13-23(20,25)12-10-17-8-6-5-7-9-17/h5-9,11,13,19-21,25H,4,14-16H2,1-3H3