2-bromanyl-3-[4-(dimethylamino)pyridin-1-ium-1-yl]propanamide bromide

Systemtic Name: 2-bromanyl-3-[4-(dimethylamino)pyridin-1-ium-1-yl]propanamide bromide Openeye Name: 2-bromo-3-[4-(dimethylamino)pyridin-1-ium-1-yl]propanamide bromide CAS Name: 2-bromo-3-[4-(dimethylamino)-1-pyridin-1-iumyl]propanamide bromide IUPAC Name: 2-bromo-3-[4-(dimethylamino)pyridin-1-ium-1-yl]propanamide bromide Traditional Name: 2-bromo-3-[4-(dimethylamino)pyridin-1-ium-1-yl]propionamide bromide Formula: C10H15Br2N3O MolecularWeight: 353.0536

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CC(C(=O)N)Br.[Br-]

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CC(C(=O)N)Br.[Br-]

InChI

InChI=1S/C10H14BrN3O.BrH/c1-13(2)8-3-5-14(6-4-8)7-9(11)10(12)15;/h3-6,9H,7H2,1-2H3,(H-,12,15);1H