3-[[3-ethoxycarbonyl-1-(4-fluorophenyl)-6-oxidanylidene-pyridazin-4-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[3-ethoxycarbonyl-1-(4-fluorophenyl)-6-oxidanylidene-pyridazin-4-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[3-ethoxycarbonyl-1-(4-fluorophenyl)-6-oxo-pyridazin-4-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[3-ethoxycarbonyl-1-(4-fluorophenyl)-6-oxo-4-pyridazinyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[3-ethoxycarbonyl-1-(4-fluorophenyl)-6-oxopyridazin-4-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[3-carbethoxy-1-(4-fluorophenyl)-6-keto-pyridazin-4-yl]amino]propyl-dimethyl-ammonium Formula: C18H24FN4O3+ MolecularWeight: 363.406563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NCCC[NH+](C)C)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NCCC[NH+](C)C)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H23FN4O3/c1-4-26-18(25)17-15(20-10-5-11-22(2)3)12-16(24)23(21-17)14-8-6-13(19)7-9-14/h6-9,12,20H,4-5,10-11H2,1-3H3/p+1