N-[2-(2,6-dimethylpiperidin-1-ium-1-yl)ethyl]-2-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CCNC(=O)CN2C(=O)C=CC(=N2)C3=CC=C(C=C3)C)C

Isomeric SMILES

CC1CCCC([NH+]1CCNC(=O)CN2C(=O)C=CC(=N2)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C22H30N4O2/c1-16-7-9-19(10-8-16)20-11-12-22(28)26(24-20)15-21(27)23-13-14-25-17(2)5-4-6-18(25)3/h7-12,17-18H,4-6,13-15H2,1-3H3,(H,23,27)/p+1