2-[4-(3-chlorophenyl)-1-ethyl-7-methyl-2-oxidanylidene-cinnolin-2-ium-3-yl]-N,N-dimethyl-ethanamine

Systemtic Name: 2-[4-(3-chlorophenyl)-1-ethyl-7-methyl-2-oxidanylidene-cinnolin-2-ium-3-yl]-N,N-dimethyl-ethanamine Openeye Name: 2-[4-(3-chlorophenyl)-1-ethyl-7-methyl-2-oxo-cinnolin-2-ium-3-yl]-N,N-dimethyl-ethanamine CAS Name: 2-[4-(3-chlorophenyl)-1-ethyl-7-methyl-2-oxo-3-cinnolin-2-iumyl]-N,N-dimethylethanamine IUPAC Name: 2-[4-(3-chlorophenyl)-1-ethyl-7-methyl-2-oxocinnolin-2-ium-3-yl]-N,N-dimethylethanamine Traditional Name: 2-[4-(3-chlorophenyl)-1-ethyl-2-keto-7-methyl-cinnolin-2-ium-3-yl]ethyl-dimethyl-amine Formula: C21H25ClN3O+ MolecularWeight: 370.8957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C)C(=C([N+]1=O)CCN(C)C)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCN1C2=C(C=CC(=C2)C)C(=C([N+]1=O)CCN(C)C)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H25ClN3O/c1-5-24-20-13-15(2)9-10-18(20)21(16-7-6-8-17(22)14-16)19(25(24)26)11-12-23(3)4/h6-10,13-14H,5,11-12H2,1-4H3/q+1