[4-(2-azaniumylethanoyl)phenyl]-diethyl-azanium dibromide

Systemtic Name: [4-(2-azaniumylethanoyl)phenyl]-diethyl-azanium dibromide Openeye Name: [4-(2-azaniumylacetyl)phenyl]-diethyl-ammonium dibromide CAS Name: [4-(2-ammonio-1-oxoethyl)phenyl]-diethylammonium dibromide IUPAC Name: [4-(2-azaniumylacetyl)phenyl]-diethylazanium dibromide Traditional Name: [4-(2-ammonioacetyl)phenyl]-diethyl-ammonium dibromide Formula: C12H20Br2N2O MolecularWeight: 368.108

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1=CC=C(C=C1)C(=O)C[NH3+].[Br-].[Br-]

Isomeric SMILES

CC[NH+](CC)C1=CC=C(C=C1)C(=O)C[NH3+].[Br-].[Br-]

InChI

InChI=1S/C12H18N2O.2BrH/c1-3-14(4-2)11-7-5-10(6-8-11)12(15)9-13;;/h5-8H,3-4,9,13H2,1-2H3;2*1H