4-(4-butylpiperidin-1-yl)-1-(2,4-dimethylphenyl)butan-1-one

Systemtic Name: 4-(4-butylpiperidin-1-yl)-1-(2,4-dimethylphenyl)butan-1-one Openeye Name: 4-(4-butyl-1-piperidyl)-1-(2,4-dimethylphenyl)butan-1-one CAS Name: 4-(4-butyl-1-piperidinyl)-1-(2,4-dimethylphenyl)-1-butanone IUPAC Name: 4-(4-butylpiperidin-1-yl)-1-(2,4-dimethylphenyl)butan-1-one Traditional Name: 4-(4-butylpiperidino)-1-(2,4-dimethylphenyl)butan-1-one Formula: C21H33NO MolecularWeight: 315.49282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)CCCC(=O)C2=C(C=C(C=C2)C)C

Isomeric SMILES

CCCCC1CCN(CC1)CCCC(=O)C2=C(C=C(C=C2)C)C

InChI

InChI=1S/C21H33NO/c1-4-5-7-19-11-14-22(15-12-19)13-6-8-21(23)20-10-9-17(2)16-18(20)3/h9-10,16,19H,4-8,11-15H2,1-3H3