N-[(2,4-dichlorophenyl)methyl]-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(2,4-dichlorophenyl)methyl]-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,4-dichlorobenzyl)-2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetamide Formula: C18H20Cl2N3O3+ MolecularWeight: 397.2757

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCC2=C(C=C(C=C2)Cl)Cl)C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCC2=C(C=C(C=C2)Cl)Cl)C(=O)C3=CC=CO3

InChI

InChI=1S/C18H19Cl2N3O3/c19-14-4-3-13(15(20)10-14)11-21-17(24)12-22-5-7-23(8-6-22)18(25)16-2-1-9-26-16/h1-4,9-10H,5-8,11-12H2,(H,21,24)/p+1