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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CCC(=O)N(N2)CCC(=O)NCCC[NH+]3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C2=CCC(=O)N(N2)CCC(=O)NCCC[NH+]3CCCC3

InChI

InChI=1S/C21H30N4O3/c1-28-18-7-5-17(6-8-18)19-9-10-21(27)25(23-19)16-11-20(26)22-12-4-15-24-13-2-3-14-24/h5-9,23H,2-4,10-16H2,1H3,(H,22,26)/p+1