1-(dimethylamino)-2-methyl-4-(phenylmethylidene)heptane-3,5-dione hydrobromide

Systemtic Name: 1-(dimethylamino)-2-methyl-4-(phenylmethylidene)heptane-3,5-dione hydrobromide Openeye Name: 4-benzylidene-1-(dimethylamino)-2-methyl-heptane-3,5-dione hydrobromide CAS Name: 1-(dimethylamino)-2-methyl-4-(phenylmethylene)heptane-3,5-dione hydrobromide IUPAC Name: 4-benzylidene-1-(dimethylamino)-2-methylheptane-3,5-dione hydrobromide Traditional Name: 4-benzal-1-(dimethylamino)-2-methyl-heptane-3,5-dione hydrobromide Formula: C17H24BrNO2 MolecularWeight: 354.28196

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=CC1=CC=CC=C1)C(=O)C(C)CN(C)C.Br

Isomeric SMILES

CCC(=O)C(=CC1=CC=CC=C1)C(=O)C(C)CN(C)C.Br

InChI

InChI=1S/C17H23NO2.BrH/c1-5-16(19)15(11-14-9-7-6-8-10-14)17(20)13(2)12-18(3)4;/h6-11,13H,5,12H2,1-4H3;1H