N-(2-methoxy-5-nitro-phenyl)-4-[(2S)-2-(phenylmethyl)pyrrolidin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-4-[(2S)-2-(phenylmethyl)pyrrolidin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-[(2S)-2-benzylpyrrolidine-1-carbonyl]-N-(2-methoxy-5-nitro-phenyl)benzenesulfonamide CAS Name: N-(2-methoxy-5-nitrophenyl)-4-[oxo-[(2S)-2-(phenylmethyl)-1-pyrrolidinyl]methyl]benzenesulfonamide IUPAC Name: 4-[(2S)-2-benzylpyrrolidine-1-carbonyl]-N-(2-methoxy-5-nitrophenyl)benzenesulfonamide Traditional Name: 4-[(2S)-2-benzylpyrrolidine-1-carbonyl]-N-(2-methoxy-5-nitro-phenyl)benzenesulfonamide Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCCC3CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC[C@H]3CC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O6S/c1-34-24-14-11-21(28(30)31)17-23(24)26-35(32,33)22-12-9-19(10-13-22)25(29)27-15-5-8-20(27)16-18-6-3-2-4-7-18/h2-4,6-7,9-14,17,20,26H,5,8,15-16H2,1H3/t20-/m0/s1