3-[2-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanoylamino]propyl-bis(2-methylpropyl)azanium

Systemtic Name: 3-[2-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanoylamino]propyl-bis(2-methylpropyl)azanium Openeye Name: diisobutyl-[3-[[2-[6-oxo-3-(p-tolyl)pyridazin-1-yl]acetyl]amino]propyl]ammonium CAS Name: 3-[[2-[3-(4-methylphenyl)-6-oxo-1-pyridazinyl]-1-oxoethyl]amino]propyl-bis(2-methylpropyl)ammonium IUPAC Name: 3-[[2-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]acetyl]amino]propyl-bis(2-methylpropyl)azanium Traditional Name: diisobutyl-[3-[[2-[6-keto-3-(p-tolyl)pyridazin-1-yl]acetyl]amino]propyl]ammonium Formula: C24H37N4O2+ MolecularWeight: 413.57618

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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+](CC(C)C)CC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H36N4O2/c1-18(2)15-27(16-19(3)4)14-6-13-25-23(29)17-28-24(30)12-11-22(26-28)21-9-7-20(5)8-10-21/h7-12,18-19H,6,13-17H2,1-5H3,(H,25,29)/p+1