ethyl 2-(6-bromanyl-4-oxidanylidene-1H-cinnolin-2-ium-2-yl)ethanoate chloride

Systemtic Name: ethyl 2-(6-bromanyl-4-oxidanylidene-1H-cinnolin-2-ium-2-yl)ethanoate chloride Openeye Name: ethyl 2-(6-bromo-4-oxo-1H-cinnolin-2-ium-2-yl)acetate chloride CAS Name: 2-(6-bromo-4-oxo-1H-cinnolin-2-ium-2-yl)acetic acid ethyl ester chloride IUPAC Name: ethyl 2-(6-bromo-4-oxo-1H-cinnolin-2-ium-2-yl)acetate chloride Traditional Name: 2-(6-bromo-4-keto-1H-cinnolin-2-ium-2-yl)acetic acid ethyl ester chloride Formula: C12H12BrClN2O3 MolecularWeight: 347.59228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=CC(=O)C2=C(N1)C=CC(=C2)Br.[Cl-]

Isomeric SMILES

CCOC(=O)C[N+]1=CC(=O)C2=C(N1)C=CC(=C2)Br.[Cl-]

InChI

InChI=1S/C12H11BrN2O3.ClH/c1-2-18-12(17)7-15-6-11(16)9-5-8(13)3-4-10(9)14-15;/h3-6H,2,7H2,1H3;1H