(2-chloranyl-4-fluoranyl-phenyl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (2-chloro-4-fluoro-phenyl)-[4-(2-furylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (2-chloro-4-fluorophenyl)-[4-(2-furanylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (2-chloro-4-fluorophenyl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (2-chloro-4-fluoro-phenyl)-[4-(2-furfuryl)piperazin-4-ium-1-yl]methanone Formula: C16H17ClFN2O2+ MolecularWeight: 323.769783

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)C3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)C3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H16ClFN2O2/c17-15-10-12(18)3-4-14(15)16(21)20-7-5-19(6-8-20)11-13-2-1-9-22-13/h1-4,9-10H,5-8,11H2/p+1