4-methoxy-N-(2-methyl-5-nitro-phenyl)-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide

Systemtic Name: 4-methoxy-N-(2-methyl-5-nitro-phenyl)-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: 4-methoxy-N-(2-methyl-5-nitro-phenyl)-3-(pyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: 4-methoxy-N-(2-methyl-5-nitrophenyl)-3-[oxo(1-pyrrolidinyl)methyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-(2-methyl-5-nitrophenyl)-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: 4-methoxy-N-(2-methyl-5-nitro-phenyl)-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCC3

InChI

InChI=1S/C19H21N3O6S/c1-13-5-6-14(22(24)25)11-17(13)20-29(26,27)15-7-8-18(28-2)16(12-15)19(23)21-9-3-4-10-21/h5-8,11-12,20H,3-4,9-10H2,1-2H3