5-nitro-3-(phenylsulfonyl)pyridin-1-ium-2-amine

Systemtic Name: 5-nitro-3-(phenylsulfonyl)pyridin-1-ium-2-amine Openeye Name: 3-(benzenesulfonyl)-5-nitro-pyridin-1-ium-2-amine CAS Name: 3-(benzenesulfonyl)-5-nitro-2-pyridin-1-iumamine IUPAC Name: 3-(benzenesulfonyl)-5-nitropyridin-1-ium-2-amine Traditional Name: (3-besyl-5-nitro-pyridin-1-ium-2-yl)amine Formula: C11H10N3O4S+ MolecularWeight: 280.2798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=C([NH+]=CC(=C2)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=C([NH+]=CC(=C2)[N+](=O)[O-])N

InChI

InChI=1S/C11H9N3O4S/c12-11-10(6-8(7-13-11)14(15)16)19(17,18)9-4-2-1-3-5-9/h1-7H,(H2,12,13)/p+1