(3E)-3-hydroxyimino-1-pyridin-1-ium-1-yl-butan-2-one bromide

Systemtic Name: (3E)-3-hydroxyimino-1-pyridin-1-ium-1-yl-butan-2-one bromide Openeye Name: (3E)-3-hydroxyimino-1-pyridin-1-ium-1-yl-butan-2-one bromide CAS Name: (3E)-3-hydroxyimino-1-(1-pyridin-1-iumyl)-2-butanone bromide IUPAC Name: (3E)-3-hydroxyimino-1-pyridin-1-ium-1-ylbutan-2-one bromide Traditional Name: (3E)-3-hydroximino-1-pyridin-1-ium-1-yl-butan-2-one bromide Formula: C9H11BrN2O2 MolecularWeight: 259.09984

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NO)C(=O)C[N+]1=CC=CC=C1.[Br-]

Isomeric SMILES

C/C(=N\O)/C(=O)C[N+]1=CC=CC=C1.[Br-]

InChI

InChI=1S/C9H10N2O2.BrH/c1-8(10-13)9(12)7-11-5-3-2-4-6-11;/h2-6H,7H2,1H3;1H