N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-(2-morpholin-4-ium-4-ylethyl)-3H-phthalazine-1-carboxamide Formula: C15H19N4O3+ MolecularWeight: 303.33636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C15H18N4O3/c20-14-12-4-2-1-3-11(12)13(17-18-14)15(21)16-5-6-19-7-9-22-10-8-19/h1-4H,5-10H2,(H,16,21)(H,18,20)/p+1