3-[6-(4-methylphenyl)-3-oxidanylidene-1,4-dihydropyridazin-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)propanamide

Systemtic Name: 3-[6-(4-methylphenyl)-3-oxidanylidene-1,4-dihydropyridazin-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)propanamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-[3-oxo-6-(p-tolyl)-1,4-dihydropyridazin-2-yl]propanamide CAS Name: 3-[6-(4-methylphenyl)-3-oxo-1,4-dihydropyridazin-2-yl]-N-[3-(4-morpholin-4-iumyl)propyl]propanamide IUPAC Name: 3-[6-(4-methylphenyl)-3-oxo-1,4-dihydropyridazin-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)propanamide Traditional Name: 3-[3-keto-6-(p-tolyl)-1,4-dihydropyridazin-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)propionamide Formula: C21H31N4O3+ MolecularWeight: 387.49584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CCC(=O)N(N2)CCC(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CCC(=O)N(N2)CCC(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C21H30N4O3/c1-17-3-5-18(6-4-17)19-7-8-21(27)25(23-19)12-9-20(26)22-10-2-11-24-13-15-28-16-14-24/h3-7,23H,2,8-16H2,1H3,(H,22,26)/p+1