butyl-[2-[3-[3-(4-chlorophenyl)-6-oxidanylidene-pyridazin-1-yl]propanoylamino]ethyl]-methyl-azanium

Systemtic Name: butyl-[2-[3-[3-(4-chlorophenyl)-6-oxidanylidene-pyridazin-1-yl]propanoylamino]ethyl]-methyl-azanium Openeye Name: butyl-[2-[3-[3-(4-chlorophenyl)-6-oxo-pyridazin-1-yl]propanoylamino]ethyl]-methyl-ammonium CAS Name: butyl-[2-[[3-[3-(4-chlorophenyl)-6-oxo-1-pyridazinyl]-1-oxopropyl]amino]ethyl]-methylammonium IUPAC Name: butyl-[2-[3-[3-(4-chlorophenyl)-6-oxopyridazin-1-yl]propanoylamino]ethyl]-methylazanium Traditional Name: butyl-[2-[3-[3-(4-chlorophenyl)-6-keto-pyridazin-1-yl]propanoylamino]ethyl]-methyl-ammonium Formula: C20H28ClN4O2+ MolecularWeight: 391.91492

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CCNC(=O)CCN1C(=O)C=CC(=N1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCC[NH+](C)CCNC(=O)CCN1C(=O)C=CC(=N1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H27ClN4O2/c1-3-4-13-24(2)15-12-22-19(26)11-14-25-20(27)10-9-18(23-25)16-5-7-17(21)8-6-16/h5-10H,3-4,11-15H2,1-2H3,(H,22,26)/p+1