N-(1-methylsulfonylpiperidin-4-yl)-4-nitro-benzenesulfonamide

Systemtic Name: N-(1-methylsulfonylpiperidin-4-yl)-4-nitro-benzenesulfonamide Openeye Name: N-(1-methylsulfonyl-4-piperidyl)-4-nitro-benzenesulfonamide CAS Name: N-(1-methylsulfonyl-4-piperidinyl)-4-nitrobenzenesulfonamide IUPAC Name: N-(1-methylsulfonylpiperidin-4-yl)-4-nitrobenzenesulfonamide Traditional Name: N-(1-mesyl-4-piperidyl)-4-nitro-benzenesulfonamide Formula: C12H17N3O6S2 MolecularWeight: 363.40988

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O6S2/c1-22(18,19)14-8-6-10(7-9-14)13-23(20,21)12-4-2-11(3-5-12)15(16)17/h2-5,10,13H,6-9H2,1H3