(4-bromanyl-1-benzothiophen-3-yl)methyl-(2-chloroethyl)-ethyl-azanium

Systemtic Name: (4-bromanyl-1-benzothiophen-3-yl)methyl-(2-chloroethyl)-ethyl-azanium Openeye Name: (4-bromobenzothiophen-3-yl)methyl-(2-chloroethyl)-ethyl-ammonium CAS Name: (4-bromo-1-benzothiophen-3-yl)methyl-(2-chloroethyl)-ethylammonium IUPAC Name: (4-bromo-1-benzothiophen-3-yl)methyl-(2-chloroethyl)-ethylazanium Traditional Name: (4-bromobenzothiophen-3-yl)methyl-(2-chloroethyl)-ethyl-ammonium Formula: C13H16BrClNS+ MolecularWeight: 333.69484

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCl)CC1=CSC2=C1C(=CC=C2)Br

Isomeric SMILES

CC[NH+](CCCl)CC1=CSC2=C1C(=CC=C2)Br

InChI

InChI=1S/C13H15BrClNS/c1-2-16(7-6-15)8-10-9-17-12-5-3-4-11(14)13(10)12/h3-5,9H,2,6-8H2,1H3/p+1