ethyl 2-(6,8-dimethyl-4-oxidanylidene-1H-cinnolin-2-ium-2-yl)ethanoate chloride

Systemtic Name: ethyl 2-(6,8-dimethyl-4-oxidanylidene-1H-cinnolin-2-ium-2-yl)ethanoate chloride Openeye Name: ethyl 2-(6,8-dimethyl-4-oxo-1H-cinnolin-2-ium-2-yl)acetate chloride CAS Name: 2-(6,8-dimethyl-4-oxo-1H-cinnolin-2-ium-2-yl)acetic acid ethyl ester chloride IUPAC Name: ethyl 2-(6,8-dimethyl-4-oxo-1H-cinnolin-2-ium-2-yl)acetate chloride Traditional Name: 2-(4-keto-6,8-dimethyl-1H-cinnolin-2-ium-2-yl)acetic acid ethyl ester chloride Formula: C14H17ClN2O3 MolecularWeight: 296.74938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=CC(=O)C2=CC(=CC(=C2N1)C)C.[Cl-]

Isomeric SMILES

CCOC(=O)C[N+]1=CC(=O)C2=CC(=CC(=C2N1)C)C.[Cl-]

InChI

InChI=1S/C14H16N2O3.ClH/c1-4-19-13(18)8-16-7-12(17)11-6-9(2)5-10(3)14(11)15-16;/h5-7H,4,8H2,1-3H3;1H