(3E)-6-(dimethylamino)-3-(thiophen-2-ylmethylidene)hexane-2,4-dione hydrobromide

Systemtic Name: (3E)-6-(dimethylamino)-3-(thiophen-2-ylmethylidene)hexane-2,4-dione hydrobromide Openeye Name: (3E)-6-(dimethylamino)-3-(2-thienylmethylene)hexane-2,4-dione hydrobromide CAS Name: (3E)-6-(dimethylamino)-3-(thiophen-2-ylmethylidene)hexane-2,4-dione hydrobromide IUPAC Name: (3E)-6-(dimethylamino)-3-(thiophen-2-ylmethylidene)hexane-2,4-dione hydrobromide Traditional Name: (3E)-6-(dimethylamino)-3-(2-thenylidene)hexane-2,4-dione hydrobromide Formula: C13H18BrNO2S MolecularWeight: 332.25652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CS1)C(=O)CCN(C)C.Br

Isomeric SMILES

CC(=O)/C(=C\C1=CC=CS1)/C(=O)CCN(C)C.Br

InChI

InChI=1S/C13H17NO2S.BrH/c1-10(15)12(9-11-5-4-8-17-11)13(16)6-7-14(2)3;/h4-5,8-9H,6-7H2,1-3H3;1H/b12-9+;