3-cyanopropyl-(2-hydroxyethyl)-dimethyl-azanium ethanoate hydrobromide

Systemtic Name: 3-cyanopropyl-(2-hydroxyethyl)-dimethyl-azanium ethanoate hydrobromide Openeye Name: 3-cyanopropyl-(2-hydroxyethyl)-dimethyl-ammonium acetate hydrobromide CAS Name: 3-cyanopropyl-(2-hydroxyethyl)-dimethylammonium acetate hydrobromide IUPAC Name: 3-cyanopropyl-(2-hydroxyethyl)-dimethylazanium acetate hydrobromide Traditional Name: 3-cyanopropyl-(2-hydroxyethyl)-dimethyl-ammonium acetate hydrobromide Formula: C10H21BrN2O3 MolecularWeight: 297.18934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H17N2O.C2H4O2.BrH/c1-10(2,7-8-11)6-4-3-5-9;1-2(3)4;/h11H,3-4,6-8H2,1-2H3;1H3,(H,3,4);1H/q+1;;/p-1