(4-bromanylthiophen-2-yl)methyl-phenethyl-azanium

Systemtic Name: (4-bromanylthiophen-2-yl)methyl-phenethyl-azanium Openeye Name: (4-bromo-2-thienyl)methyl-phenethyl-ammonium CAS Name: (4-bromo-2-thiophenyl)methyl-phenethylammonium IUPAC Name: (4-bromothiophen-2-yl)methyl-phenethylazanium Traditional Name: (4-bromo-2-thienyl)methyl-phenethyl-ammonium Formula: C13H15BrNS+ MolecularWeight: 297.2339

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[NH2+]CC2=CC(=CS2)Br

Isomeric SMILES

C1=CC=C(C=C1)CC[NH2+]CC2=CC(=CS2)Br

InChI

InChI=1S/C13H14BrNS/c14-12-8-13(16-10-12)9-15-7-6-11-4-2-1-3-5-11/h1-5,8,10,15H,6-7,9H2/p+1