5-chloranyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1H-cinnolin-2-ium-4-one

Systemtic Name: 5-chloranyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-1H-cinnolin-2-ium-4-one Openeye Name: 5-chloro-2-[2-oxo-2-(1-piperidyl)ethyl]-1H-cinnolin-2-ium-4-one CAS Name: 5-chloro-2-[2-oxo-2-(1-piperidinyl)ethyl]-1H-cinnolin-2-ium-4-one IUPAC Name: 5-chloro-2-(2-oxo-2-piperidin-1-ylethyl)-1H-cinnolin-2-ium-4-one Traditional Name: 5-chloro-2-(2-keto-2-piperidino-ethyl)-1H-cinnolin-2-ium-4-one Formula: C15H17ClN3O2+ MolecularWeight: 306.76738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C[N+]2=CC(=O)C3=C(N2)C=CC=C3Cl

Isomeric SMILES

C1CCN(CC1)C(=O)C[N+]2=CC(=O)C3=C(N2)C=CC=C3Cl

InChI

InChI=1S/C15H16ClN3O2/c16-11-5-4-6-12-15(11)13(20)9-19(17-12)10-14(21)18-7-2-1-3-8-18/h4-6,9H,1-3,7-8,10H2/p+1