diethyl-methyl-[2-[(2-oxidanyl-2-phenyl-2-thiophen-2-yl-ethanoyl)amino]ethyl]azanium bromide

Systemtic Name: diethyl-methyl-[2-[(2-oxidanyl-2-phenyl-2-thiophen-2-yl-ethanoyl)amino]ethyl]azanium bromide Openeye Name: diethyl-[2-[[2-hydroxy-2-phenyl-2-(2-thienyl)acetyl]amino]ethyl]-methyl-ammonium bromide CAS Name: diethyl-[2-[(2-hydroxy-1-oxo-2-phenyl-2-thiophen-2-ylethyl)amino]ethyl]-methylammonium bromide IUPAC Name: diethyl-[2-[(2-hydroxy-2-phenyl-2-thiophen-2-ylacetyl)amino]ethyl]-methylazanium bromide Traditional Name: diethyl-[2-[[2-hydroxy-2-phenyl-2-(2-thienyl)acetyl]amino]ethyl]-methyl-ammonium bromide Formula: C19H27BrN2O2S MolecularWeight: 427.39888

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCNC(=O)C(C1=CC=CC=C1)(C2=CC=CS2)O.[Br-]

Isomeric SMILES

CC[N+](C)(CC)CCNC(=O)C(C1=CC=CC=C1)(C2=CC=CS2)O.[Br-]

InChI

InChI=1S/C19H26N2O2S.BrH/c1-4-21(3,5-2)14-13-20-18(22)19(23,17-12-9-15-24-17)16-10-7-6-8-11-16;/h6-12,15,23H,4-5,13-14H2,1-3H3;1H