2,3-dimethyl-N-(2-methyl-6-pyrrolidin-1-ylcarbonyl-phenyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2,3-dimethyl-N-(2-methyl-6-pyrrolidin-1-ylcarbonyl-phenyl)-5-nitro-benzenesulfonamide Openeye Name: 2,3-dimethyl-N-[2-methyl-6-(pyrrolidine-1-carbonyl)phenyl]-5-nitro-benzenesulfonamide CAS Name: 2,3-dimethyl-N-[2-methyl-6-[oxo(1-pyrrolidinyl)methyl]phenyl]-5-nitrobenzenesulfonamide IUPAC Name: 2,3-dimethyl-N-[2-methyl-6-(pyrrolidine-1-carbonyl)phenyl]-5-nitrobenzenesulfonamide Traditional Name: 2,3-dimethyl-N-[2-methyl-6-(pyrrolidine-1-carbonyl)phenyl]-5-nitro-benzenesulfonamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NS(=O)(=O)C2=C(C(=CC(=C2)[N+](=O)[O-])C)C)C(=O)N3CCCC3

Isomeric SMILES

CC1=CC=CC(=C1NS(=O)(=O)C2=C(C(=CC(=C2)[N+](=O)[O-])C)C)C(=O)N3CCCC3

InChI

InChI=1S/C20H23N3O5S/c1-13-7-6-8-17(20(24)22-9-4-5-10-22)19(13)21-29(27,28)18-12-16(23(25)26)11-14(2)15(18)3/h6-8,11-12,21H,4-5,9-10H2,1-3H3