1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-4-(furan-2-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-4-(furan-2-ylmethyl)piperazin-4-ium Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-(2-furylmethyl)piperazin-4-ium CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-4-(2-furanylmethyl)piperazin-4-ium IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-4-(furan-2-ylmethyl)piperazin-4-ium Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-(2-furfuryl)piperazin-4-ium Formula: C15H17ClFN2O3S+ MolecularWeight: 359.823483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16ClFN2O3S/c16-14-10-13(3-4-15(14)17)23(20,21)19-7-5-18(6-8-19)11-12-2-1-9-22-12/h1-4,9-10H,5-8,11H2/p+1