1-[[2,3-bis(fluoranyl)phenyl]methyl]-4-thiophen-2-ylsulfonyl-piperazin-1-ium

Systemtic Name: 1-[[2,3-bis(fluoranyl)phenyl]methyl]-4-thiophen-2-ylsulfonyl-piperazin-1-ium Openeye Name: 1-[(2,3-difluorophenyl)methyl]-4-(2-thienylsulfonyl)piperazin-1-ium CAS Name: 1-[(2,3-difluorophenyl)methyl]-4-thiophen-2-ylsulfonylpiperazin-1-ium IUPAC Name: 1-[(2,3-difluorophenyl)methyl]-4-thiophen-2-ylsulfonylpiperazin-1-ium Traditional Name: 1-(2,3-difluorobenzyl)-4-(2-thienylsulfonyl)piperazin-1-ium Formula: C15H17F2N2O2S2+ MolecularWeight: 359.434486

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C(=CC=C2)F)F)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C(=CC=C2)F)F)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C15H16F2N2O2S2/c16-13-4-1-3-12(15(13)17)11-18-6-8-19(9-7-18)23(20,21)14-5-2-10-22-14/h1-5,10H,6-9,11H2/p+1