[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-[3-(furan-2-ylmethoxy)-2-oxidanyl-propyl]-dimethyl-azanium bromide

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl]-[3-(furan-2-ylmethoxy)-2-oxidanyl-propyl]-dimethyl-azanium bromide Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl]-[3-(2-furylmethoxy)-2-hydroxy-propyl]-dimethyl-ammonium bromide CAS Name: [2-(4-bromophenyl)-2-oxoethyl]-[3-(2-furanylmethoxy)-2-hydroxypropyl]-dimethylammonium bromide IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl]-[3-(furan-2-ylmethoxy)-2-hydroxypropyl]-dimethylazanium bromide Traditional Name: [2-(4-bromophenyl)-2-keto-ethyl]-[3-(2-furfuryloxy)-2-hydroxy-propyl]-dimethyl-ammonium bromide Formula: C18H23Br2NO4 MolecularWeight: 477.18752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC(COCC1=CC=CO1)O)CC(=O)C2=CC=C(C=C2)Br.[Br-]

Isomeric SMILES

C[N+](C)(CC(COCC1=CC=CO1)O)CC(=O)C2=CC=C(C=C2)Br.[Br-]

InChI

InChI=1S/C18H23BrNO4.BrH/c1-20(2,11-18(22)14-5-7-15(19)8-6-14)10-16(21)12-23-13-17-4-3-9-24-17;/h3-9,16,21H,10-13H2,1-2H3;1H/q+1;/p-1