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

Systemtic Name: 2-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]ethanamide Openeye Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-2-[6-oxo-3-(p-tolyl)pyridazin-1-yl]acetamide CAS Name: 2-[3-(4-methylphenyl)-6-oxo-1-pyridazinyl]-N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]acetamide IUPAC Name: 2-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]acetamide Traditional Name: 2-[6-keto-3-(p-tolyl)pyridazin-1-yl]-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]acetamide Formula: C22H31N4O2+ MolecularWeight: 383.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)CN2C(=O)C=CC(=N2)C3=CC=C(C=C3)C

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)CN2C(=O)C=CC(=N2)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H30N4O2/c1-17-4-6-19(7-5-17)20-8-9-22(28)26(24-20)16-21(27)23-12-3-13-25-14-10-18(2)11-15-25/h4-9,18H,3,10-16H2,1-2H3,(H,23,27)/p+1