1-[(4-oxidanylidenecinnolin-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-oxidanylidenecinnolin-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-oxocinnolin-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-oxo-1-cinnolinyl)methyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-oxocinnolin-1-yl)methyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(4-ketocinnolin-1-yl)methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C21H23N4O2+ MolecularWeight: 363.43292

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C21H22N4O2/c26-20-14-22-25(19-9-5-4-8-18(19)20)15-24-12-10-16(11-13-24)21(27)23-17-6-2-1-3-7-17/h1-9,14,16H,10-13,15H2,(H,23,27)/p+1