N-(1-methylpyrrolidin-1-ium-1-yl)-2-nitro-benzenesulfonamide

Systemtic Name: N-(1-methylpyrrolidin-1-ium-1-yl)-2-nitro-benzenesulfonamide Openeye Name: N-(1-methylpyrrolidin-1-ium-1-yl)-2-nitro-benzenesulfonamide CAS Name: N-(1-methyl-1-pyrrolidin-1-iumyl)-2-nitrobenzenesulfonamide IUPAC Name: N-(1-methylpyrrolidin-1-ium-1-yl)-2-nitrobenzenesulfonamide Traditional Name: N-(1-methylpyrrolidin-1-ium-1-yl)-2-nitro-benzenesulfonamide Formula: C11H16N3O4S+ MolecularWeight: 286.32744

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C[N+]1(CCCC1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C11H16N3O4S/c1-14(8-4-5-9-14)12-19(17,18)11-7-3-2-6-10(11)13(15)16/h2-3,6-7,12H,4-5,8-9H2,1H3/q+1