N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide

Systemtic Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide Openeye Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(4-oxocinnolin-1-yl)acetamide CAS Name: N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-2-(4-oxo-1-cinnolinyl)acetamide IUPAC Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(4-oxocinnolin-1-yl)acetamide Traditional Name: 2-(4-ketocinnolin-1-yl)-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]acetamide Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)CN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)CN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C22H24N4O3/c27-21-14-24-26(20-8-4-3-7-19(20)21)16-22(28)23-13-17-5-1-2-6-18(17)15-25-9-11-29-12-10-25/h1-8,14H,9-13,15-16H2,(H,23,28)/p+1