(5Z)-5-(bromanylmethylidene)-2,4-dimethyl-4-propan-2-yl-1,3-oxazol-3-ium bromide

Systemtic Name: (5Z)-5-(bromanylmethylidene)-2,4-dimethyl-4-propan-2-yl-1,3-oxazol-3-ium bromide Openeye Name: (5Z)-5-(bromomethylene)-4-isopropyl-2,4-dimethyl-oxazol-3-ium bromide CAS Name: (5Z)-5-(bromomethylidene)-2,4-dimethyl-4-propan-2-yloxazol-3-ium bromide IUPAC Name: (5Z)-5-(bromomethylidene)-2,4-dimethyl-4-propan-2-yl-1,3-oxazol-3-ium bromide Traditional Name: (5Z)-5-(bromomethylene)-4-isopropyl-2,4-dimethyl-2-oxazolin-3-ium bromide Formula: C9H15Br2NO MolecularWeight: 313.0295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(C(=CBr)O1)(C)C(C)C.[Br-]

Isomeric SMILES

CC1=[NH+]C(/C(=C/Br)/O1)(C)C(C)C.[Br-]

InChI

InChI=1S/C9H14BrNO.BrH/c1-6(2)9(4)8(5-10)12-7(3)11-9;/h5-6H,1-4H3;1H/b8-5-;