(5-bromanylthiophen-2-yl)methyl-[3-[methyl(phenyl)amino]propyl]azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-[3-[methyl(phenyl)amino]propyl]azanium Openeye Name: (5-bromo-2-thienyl)methyl-[3-(N-methylanilino)propyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-[3-(N-methylanilino)propyl]ammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-[3-(N-methylanilino)propyl]azanium Traditional Name: (5-bromo-2-thienyl)methyl-[3-(N-methylanilino)propyl]ammonium Formula: C15H20BrN2S+ MolecularWeight: 340.3017

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC[NH2+]CC1=CC=C(S1)Br)C2=CC=CC=C2

Isomeric SMILES

CN(CCC[NH2+]CC1=CC=C(S1)Br)C2=CC=CC=C2

InChI

InChI=1S/C15H19BrN2S/c1-18(13-6-3-2-4-7-13)11-5-10-17-12-14-8-9-15(16)19-14/h2-4,6-9,17H,5,10-12H2,1H3/p+1