2-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(3-piperidin-1-ium-1-ylpropyl)ethanamide

Systemtic Name: 2-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(3-piperidin-1-ium-1-ylpropyl)ethanamide Openeye Name: 2-[6-oxo-3-(p-tolyl)pyridazin-1-yl]-N-(3-piperidin-1-ium-1-ylpropyl)acetamide CAS Name: 2-[3-(4-methylphenyl)-6-oxo-1-pyridazinyl]-N-[3-(1-piperidin-1-iumyl)propyl]acetamide IUPAC Name: 2-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]-N-(3-piperidin-1-ium-1-ylpropyl)acetamide Traditional Name: 2-[6-keto-3-(p-tolyl)pyridazin-1-yl]-N-(3-piperidin-1-ium-1-ylpropyl)acetamide Formula: C21H29N4O2+ MolecularWeight: 369.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NCCC[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NCCC[NH+]3CCCCC3

InChI

InChI=1S/C21H28N4O2/c1-17-6-8-18(9-7-17)19-10-11-21(27)25(23-19)16-20(26)22-12-5-15-24-13-3-2-4-14-24/h6-11H,2-5,12-16H2,1H3,(H,22,26)/p+1