1-[2,4-bis(fluoranyl)phenyl]sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine Openeye Name: 1-(2,4-difluorophenyl)sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine CAS Name: 1-(2,4-difluorophenyl)sulfonyl-4-(3-nitro-2-pyridin-1-iumyl)piperazine IUPAC Name: 1-(2,4-difluorophenyl)sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine Traditional Name: 1-(2,4-difluorophenyl)sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine Formula: C15H15F2N4O4S+ MolecularWeight: 385.365806

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=[NH+]2)[N+](=O)[O-])S(=O)(=O)C3=C(C=C(C=C3)F)F

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=[NH+]2)[N+](=O)[O-])S(=O)(=O)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C15H14F2N4O4S/c16-11-3-4-14(12(17)10-11)26(24,25)20-8-6-19(7-9-20)15-13(21(22)23)2-1-5-18-15/h1-5,10H,6-9H2/p+1