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

Systemtic Name: 1-(4-butylphenyl)-5-(5,5-dimethyl-1,3-dioxan-2-yl)pentan-1-one Openeye Name: 1-(4-butylphenyl)-5-(5,5-dimethyl-1,3-dioxan-2-yl)pentan-1-one CAS Name: 1-(4-butylphenyl)-5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-pentanone IUPAC Name: 1-(4-butylphenyl)-5-(5,5-dimethyl-1,3-dioxan-2-yl)pentan-1-one Traditional Name: 1-(4-butylphenyl)-5-(5,5-dimethyl-1,3-dioxan-2-yl)pentan-1-one Formula: C21H32O3 MolecularWeight: 332.47698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)CCCCC2OCC(CO2)(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)CCCCC2OCC(CO2)(C)C

InChI

InChI=1S/C21H32O3/c1-4-5-8-17-11-13-18(14-12-17)19(22)9-6-7-10-20-23-15-21(2,3)16-24-20/h11-14,20H,4-10,15-16H2,1-3H3