5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(4-pentylphenyl)pentan-1-one

Systemtic Name: 5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(4-pentylphenyl)pentan-1-one Openeye Name: 5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(4-pentylphenyl)pentan-1-one CAS Name: 5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(4-pentylphenyl)-1-pentanone IUPAC Name: 5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(4-pentylphenyl)pentan-1-one Traditional Name: 1-(4-amylphenyl)-5-(5,5-dimethyl-1,3-dioxan-2-yl)pentan-1-one Formula: C22H34O3 MolecularWeight: 346.50356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)CCCCC2OCC(CO2)(C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)CCCCC2OCC(CO2)(C)C

InChI

InChI=1S/C22H34O3/c1-4-5-6-9-18-12-14-19(15-13-18)20(23)10-7-8-11-21-24-16-22(2,3)17-25-21/h12-15,21H,4-11,16-17H2,1-3H3