N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: 2-(4-keto-3H-phthalazin-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)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C22H24N4O3/c27-21(13-20-18-7-3-4-8-19(18)22(28)25-24-20)23-14-16-5-1-2-6-17(16)15-26-9-11-29-12-10-26/h1-8H,9-15H2,(H,23,27)(H,25,28)/p+1