2-(4-bromanylphenoxy)ethyl-[3-[(2-fluorophenyl)amino]-3-oxidanylidene-propyl]-methyl-azanium

Systemtic Name: 2-(4-bromanylphenoxy)ethyl-[3-[(2-fluorophenyl)amino]-3-oxidanylidene-propyl]-methyl-azanium Openeye Name: 2-(4-bromophenoxy)ethyl-[3-(2-fluoroanilino)-3-oxo-propyl]-methyl-ammonium CAS Name: 2-(4-bromophenoxy)ethyl-[3-(2-fluoroanilino)-3-oxopropyl]-methylammonium IUPAC Name: 2-(4-bromophenoxy)ethyl-[3-(2-fluoroanilino)-3-oxopropyl]-methylazanium Traditional Name: 2-(4-bromophenoxy)ethyl-[3-(2-fluoroanilino)-3-keto-propyl]-methyl-ammonium Formula: C18H21BrFN2O2+ MolecularWeight: 396.273943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(=O)NC1=CC=CC=C1F)CCOC2=CC=C(C=C2)Br

Isomeric SMILES

C[NH+](CCC(=O)NC1=CC=CC=C1F)CCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H20BrFN2O2/c1-22(12-13-24-15-8-6-14(19)7-9-15)11-10-18(23)21-17-5-3-2-4-16(17)20/h2-9H,10-13H2,1H3,(H,21,23)/p+1