2-(4-chlorophenyl)-6-(4-phenethylpiperazin-4-ium-1-yl)carbonyl-1,4-dihydropyridazin-3-one

Systemtic Name: 2-(4-chlorophenyl)-6-(4-phenethylpiperazin-4-ium-1-yl)carbonyl-1,4-dihydropyridazin-3-one Openeye Name: 2-(4-chlorophenyl)-6-(4-phenethylpiperazin-4-ium-1-carbonyl)-1,4-dihydropyridazin-3-one CAS Name: 2-(4-chlorophenyl)-6-[oxo-(4-phenethyl-1-piperazin-4-iumyl)methyl]-1,4-dihydropyridazin-3-one IUPAC Name: 2-(4-chlorophenyl)-6-(4-phenethylpiperazin-4-ium-1-carbonyl)-1,4-dihydropyridazin-3-one Traditional Name: 2-(4-chlorophenyl)-6-(4-phenethylpiperazin-4-ium-1-carbonyl)-1,4-dihydropyridazin-3-one Formula: C23H26ClN4O2+ MolecularWeight: 425.93114

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)C3=CCC(=O)N(N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)C3=CCC(=O)N(N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H25ClN4O2/c24-19-6-8-20(9-7-19)28-22(29)11-10-21(25-28)23(30)27-16-14-26(15-17-27)13-12-18-4-2-1-3-5-18/h1-10,25H,11-17H2/p+1