1-(3-fluorophenyl)sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine

Systemtic Name: 1-(3-fluorophenyl)sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine Openeye Name: 1-(3-fluorophenyl)sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine CAS Name: 1-(3-fluorophenyl)sulfonyl-4-(3-nitro-2-pyridin-1-iumyl)piperazine IUPAC Name: 1-(3-fluorophenyl)sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine Traditional Name: 1-(3-fluorophenyl)sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine Formula: C15H16FN4O4S+ MolecularWeight: 367.375343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15FN4O4S/c16-12-3-1-4-13(11-12)25(23,24)19-9-7-18(8-10-19)15-14(20(21)22)5-2-6-17-15/h1-6,11H,7-10H2/p+1