3,4-bis(fluoranyl)-N-(2-piperazin-4-ium-1-ylsulfonylethyl)benzamide

Systemtic Name: 3,4-bis(fluoranyl)-N-(2-piperazin-4-ium-1-ylsulfonylethyl)benzamide Openeye Name: 3,4-difluoro-N-(2-piperazin-4-ium-1-ylsulfonylethyl)benzamide CAS Name: 3,4-difluoro-N-[2-(1-piperazin-4-iumylsulfonyl)ethyl]benzamide IUPAC Name: 3,4-difluoro-N-(2-piperazin-4-ium-1-ylsulfonylethyl)benzamide Traditional Name: 3,4-difluoro-N-(2-piperazin-4-ium-1-ylsulfonylethyl)benzamide Formula: C13H18F2N3O3S+ MolecularWeight: 334.362126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)CCNC(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)CCNC(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C13H17F2N3O3S/c14-11-2-1-10(9-12(11)15)13(19)17-5-8-22(20,21)18-6-3-16-4-7-18/h1-2,9,16H,3-8H2,(H,17,19)/p+1