ethyl 2-(8-chloranyl-4-oxidanylidene-1H-cinnolin-2-ium-2-yl)ethanoate

Systemtic Name: ethyl 2-(8-chloranyl-4-oxidanylidene-1H-cinnolin-2-ium-2-yl)ethanoate Openeye Name: ethyl 2-(8-chloro-4-oxo-1H-cinnolin-2-ium-2-yl)acetate CAS Name: 2-(8-chloro-4-oxo-1H-cinnolin-2-ium-2-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(8-chloro-4-oxo-1H-cinnolin-2-ium-2-yl)acetate Traditional Name: 2-(8-chloro-4-keto-1H-cinnolin-2-ium-2-yl)acetic acid ethyl ester Formula: C12H12ClN2O3+ MolecularWeight: 267.68828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11ClN2O3/c1-2-18-11(17)7-15-6-10(16)8-4-3-5-9(13)12(8)14-15/h3-6H,2,7H2,1H3/p+1