2,3-dimethyl-5-nitro-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]benzenesulfonamide

Systemtic Name: 2,3-dimethyl-5-nitro-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]benzenesulfonamide Openeye Name: 2,3-dimethyl-5-nitro-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]benzenesulfonamide CAS Name: 2,3-dimethyl-5-nitro-N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]benzenesulfonamide IUPAC Name: 2,3-dimethyl-5-nitro-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]benzenesulfonamide Traditional Name: 2,3-dimethyl-5-nitro-N-[4-(pyrrolidine-1-carbonyl)benzyl]benzenesulfonamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5S/c1-14-11-18(23(25)26)12-19(15(14)2)29(27,28)21-13-16-5-7-17(8-6-16)20(24)22-9-3-4-10-22/h5-8,11-12,21H,3-4,9-10,13H2,1-2H3