Ammonium, diethyl(2-(alpha-hydroxy-N-methyl-alpha-phenyl-2-thiopheneacetamido)ethyl)methyl-, bromide

HCID 33282

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Basic information

CAS: 26058-54-8
Standard SMILES: CC[N+](C)(CC)CCN(C)C(=O)C(O)(c1ccccc1)c1cccs1.[Br-]
InChIKey: WWODOPWOVMTINM-UHFFFAOYSA-M
Molecular formula: C20H29BrN2O2S
Average molar mass: 441.4 g/mol
Monoisotopic mass: 440.11331

Names & identifiers

Preferred name: Ammonium, diethyl(2-(alpha-hydroxy-N-methyl-alpha-phenyl-2-thiopheneacetamido)ethyl)methyl-, bromide
IUPAC: diethyl-[2-[(2-hydroxy-2-phenyl-2-thiophen-2-ylacetyl)-methylamino]ethyl]-methylazanium bromide

Names & synonyms

FC 10826058-54-8Ammonium, diethyl(2-(alpha-hydroxy-N-methyl-alpha-phenyl-2-thiopheneacetamido)ethyl)methyl-, bromideRefChem:319213DTXSID60948939N,N-Diethyl-2-[2-hydroxy-N-methyl-2-phenyl-2-(thiophen-2-yl)acetamido]-N-methylethan-1-aminium bromideN,N-Diethyl-2-{[hydroxy(phenyl)(thiophen-2-yl)acetyl](methyl)amino}-N-methylethan-1-aminium bromide

Database identifiers

CAS: 26058-54-8
PubChem CID: 33282
DTXSID: DTXSID60948939

Properties

Computed structural properties

Topological polar surface area: 68.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 8
Heavy atoms: 26
Formal charge: 0
Complexity: 435

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