2-cyanoethyl-(2-hydroxyethyl)-dimethyl-azanium bromide ethanoate

Systemtic Name: 2-cyanoethyl-(2-hydroxyethyl)-dimethyl-azanium bromide ethanoate Openeye Name: 2-cyanoethyl-(2-hydroxyethyl)-dimethyl-ammonium acetate bromide CAS Name: 2-cyanoethyl-(2-hydroxyethyl)-dimethylammonium acetate bromide IUPAC Name: 2-cyanoethyl-(2-hydroxyethyl)-dimethylazanium acetate bromide Traditional Name: 2-cyanoethyl-(2-hydroxyethyl)-dimethyl-ammonium acetate bromide Formula: C9H18BrN2O3- MolecularWeight: 282.15482

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].C[N+](C)(CCC#N)CCO.[Br-]

Isomeric SMILES

CC(=O)[O-].C[N+](C)(CCC#N)CCO.[Br-]

InChI

InChI=1S/C7H15N2O.C2H4O2.BrH/c1-9(2,6-7-10)5-3-4-8;1-2(3)4;/h10H,3,5-7H2,1-2H3;1H3,(H,3,4);1H/q+1;;/p-2