4-(4-butylpiperidin-1-yl)-3-methyl-1-(2-methylphenyl)butan-1-one

Systemtic Name: 4-(4-butylpiperidin-1-yl)-3-methyl-1-(2-methylphenyl)butan-1-one Openeye Name: 4-(4-butyl-1-piperidyl)-3-methyl-1-(o-tolyl)butan-1-one CAS Name: 4-(4-butyl-1-piperidinyl)-3-methyl-1-(2-methylphenyl)-1-butanone IUPAC Name: 4-(4-butylpiperidin-1-yl)-3-methyl-1-(2-methylphenyl)butan-1-one Traditional Name: 4-(4-butylpiperidino)-3-methyl-1-(o-tolyl)butan-1-one Formula: C21H33NO MolecularWeight: 315.49282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)CC(C)CC(=O)C2=CC=CC=C2C

Isomeric SMILES

CCCCC1CCN(CC1)CC(C)CC(=O)C2=CC=CC=C2C

InChI

InChI=1S/C21H33NO/c1-4-5-9-19-11-13-22(14-12-19)16-17(2)15-21(23)20-10-7-6-8-18(20)3/h6-8,10,17,19H,4-5,9,11-16H2,1-3H3