(5-bromanylthiophen-2-yl)methyl-[2-[2-(4-chloranylphenoxy)ethylamino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-[2-[2-(4-chloranylphenoxy)ethylamino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (5-bromo-2-thienyl)methyl-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl]-methylammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl]-methylazanium Traditional Name: (5-bromo-2-thienyl)methyl-[2-[2-(4-chlorophenoxy)ethylamino]-2-keto-ethyl]-methyl-ammonium Formula: C16H19BrClN2O2S+ MolecularWeight: 418.75626

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(S1)Br)CC(=O)NCCOC2=CC=C(C=C2)Cl

Isomeric SMILES

C[NH+](CC1=CC=C(S1)Br)CC(=O)NCCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H18BrClN2O2S/c1-20(10-14-6-7-15(17)23-14)11-16(21)19-8-9-22-13-4-2-12(18)3-5-13/h2-7H,8-11H2,1H3,(H,19,21)/p+1