2-methyl-N-(1-methylsulfonylpiperidin-4-yl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-methyl-N-(1-methylsulfonylpiperidin-4-yl)-5-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-(1-methylsulfonyl-4-piperidyl)-5-nitro-benzenesulfonamide CAS Name: 2-methyl-N-(1-methylsulfonyl-4-piperidinyl)-5-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-(1-methylsulfonylpiperidin-4-yl)-5-nitrobenzenesulfonamide Traditional Name: N-(1-mesyl-4-piperidyl)-2-methyl-5-nitro-benzenesulfonamide Formula: C13H19N3O6S2 MolecularWeight: 377.43646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C13H19N3O6S2/c1-10-3-4-12(16(17)18)9-13(10)24(21,22)14-11-5-7-15(8-6-11)23(2,19)20/h3-4,9,11,14H,5-8H2,1-2H3