2,3-dimethyl-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2,3-dimethyl-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-5-nitro-benzenesulfonamide Openeye Name: 2,3-dimethyl-N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-5-nitro-benzenesulfonamide CAS Name: 2,3-dimethyl-N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-5-nitrobenzenesulfonamide IUPAC Name: 2,3-dimethyl-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-5-nitrobenzenesulfonamide Traditional Name: 2,3-dimethyl-N-(2-methyl-5-piperidinosulfonyl-phenyl)-5-nitro-benzenesulfonamide Formula: C20H25N3O6S2 MolecularWeight: 467.559

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NS(=O)(=O)C3=C(C(=CC(=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NS(=O)(=O)C3=C(C(=CC(=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C20H25N3O6S2/c1-14-7-8-18(31(28,29)22-9-5-4-6-10-22)13-19(14)21-30(26,27)20-12-17(23(24)25)11-15(2)16(20)3/h7-8,11-13,21H,4-6,9-10H2,1-3H3