(NE)-N-[(1-phenethylpyridin-1-ium-3-yl)methylidene]hydroxylamine bromide

Systemtic Name: (NE)-N-[(1-phenethylpyridin-1-ium-3-yl)methylidene]hydroxylamine bromide Openeye Name: (3E)-1-phenethylpyridin-1-ium-3-carbaldehyde oxime bromide CAS Name: (3E)-1-phenethyl-3-pyridin-1-iumcarboxaldehyde oxime bromide IUPAC Name: (NE)-N-[(1-phenethylpyridin-1-ium-3-yl)methylidene]hydroxylamine bromide Traditional Name: (3E)-1-phenethylpyridin-1-ium-3-carbaldehyde oxime bromide Formula: C14H15BrN2O MolecularWeight: 307.1857

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[N+]2=CC=CC(=C2)C=NO.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)CC[N+]2=CC=CC(=C2)/C=N/O.[Br-]

InChI

InChI=1S/C14H14N2O.BrH/c17-15-11-14-7-4-9-16(12-14)10-8-13-5-2-1-3-6-13;/h1-7,9,11-12H,8,10H2;1H/b15-11+;