[2-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]-trimethyl-azanium bromide

Systemtic Name: [2-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]-trimethyl-azanium bromide Openeye Name: [2-(2-benzoyl-4-chloro-anilino)-2-oxo-ethyl]-trimethyl-ammonium bromide CAS Name: [2-(2-benzoyl-4-chloroanilino)-2-oxoethyl]-trimethylammonium bromide IUPAC Name: [2-(2-benzoyl-4-chloroanilino)-2-oxoethyl]-trimethylazanium bromide Traditional Name: [2-(2-benzoyl-4-chloro-anilino)-2-keto-ethyl]-trimethyl-ammonium bromide Formula: C18H20BrClN2O2 MolecularWeight: 411.7206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2.[Br-]

Isomeric SMILES

C[N+](C)(C)CC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2.[Br-]

InChI

InChI=1S/C18H19ClN2O2.BrH/c1-21(2,3)12-17(22)20-16-10-9-14(19)11-15(16)18(23)13-7-5-4-6-8-13;/h4-11H,12H2,1-3H3;1H