1-[4-(2-chlorophenyl)piperazin-1-yl]-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-[4-(2-chlorophenyl)-1-piperazinyl]-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-[4-(2-chlorophenyl)piperazin-1-yl]-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-[4-(2-chlorophenyl)piperazino]-2-[4-(2-furoyl)piperazin-1-ium-1-yl]ethanone Formula: C21H26ClN4O3+ MolecularWeight: 417.90914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C3=CC=CC=C3Cl)C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C3=CC=CC=C3Cl)C(=O)C4=CC=CO4

InChI

InChI=1S/C21H25ClN4O3/c22-17-4-1-2-5-18(17)24-11-13-25(14-12-24)20(27)16-23-7-9-26(10-8-23)21(28)19-6-3-15-29-19/h1-6,15H,7-14,16H2/p+1