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

Systemtic Name: 2-[4-(1-methyl-6-oxidanylidene-pyridazin-3-yl)carbonylpiperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-(1-methyl-6-oxo-pyridazine-3-carbonyl)piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-[(1-methyl-6-oxo-3-pyridazinyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-(1-methyl-6-oxopyridazine-3-carbonyl)piperazin-1-ium-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-(6-keto-1-methyl-pyridazine-3-carbonyl)piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C19H24N5O3+ MolecularWeight: 370.42556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=NN(C(=O)C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=NN(C(=O)C=C3)C

InChI

InChI=1S/C19H23N5O3/c1-14-3-5-15(6-4-14)20-17(25)13-23-9-11-24(12-10-23)19(27)16-7-8-18(26)22(2)21-16/h3-8H,9-13H2,1-2H3,(H,20,25)/p+1