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

Systemtic Name: 4-methoxy-N-(2-methyl-3-nitro-phenyl)-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: 4-methoxy-N-(2-methyl-3-nitro-phenyl)-3-(pyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: 4-methoxy-N-(2-methyl-3-nitrophenyl)-3-[oxo(1-pyrrolidinyl)methyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-(2-methyl-3-nitrophenyl)-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: 4-methoxy-N-(2-methyl-3-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=CC=C1[N+](=O)[O-])NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCC3

Isomeric SMILES

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

InChI

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