1-[4-(3-ethenylphenyl)-3,4-dimethyl-piperidin-1-yl]hexan-1-one

Systemtic Name: 1-[4-(3-ethenylphenyl)-3,4-dimethyl-piperidin-1-yl]hexan-1-one Openeye Name: 1-[3,4-dimethyl-4-(3-vinylphenyl)-1-piperidyl]hexan-1-one CAS Name: 1-[4-(3-ethenylphenyl)-3,4-dimethyl-1-piperidinyl]-1-hexanone IUPAC Name: 1-[4-(3-ethenylphenyl)-3,4-dimethylpiperidin-1-yl]hexan-1-one Traditional Name: 1-[3,4-dimethyl-4-(3-vinylphenyl)piperidino]hexan-1-one Formula: C21H31NO MolecularWeight: 313.47694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCC(C(C1)C)(C)C2=CC=CC(=C2)C=C

Isomeric SMILES

CCCCCC(=O)N1CCC(C(C1)C)(C)C2=CC=CC(=C2)C=C

InChI

InChI=1S/C21H31NO/c1-5-7-8-12-20(23)22-14-13-21(4,17(3)16-22)19-11-9-10-18(6-2)15-19/h6,9-11,15,17H,2,5,7-8,12-14,16H2,1,3-4H3