N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-oxocinnolin-1-yl)acetamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-2-(4-oxo-1-cinnolinyl)acetamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-oxocinnolin-1-yl)acetamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-2-(4-ketocinnolin-1-yl)acetamide Formula: C22H24ClN4O2+ MolecularWeight: 411.90456

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CN2C3=CC=CC=C3C(=O)C=N2)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CN2C3=CC=CC=C3C(=O)C=N2)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H23ClN4O2/c23-17-7-5-16(6-8-17)14-26-11-9-18(10-12-26)25-22(29)15-27-20-4-2-1-3-19(20)21(28)13-24-27/h1-8,13,18H,9-12,14-15H2,(H,25,29)/p+1