N-(2-methyl-5-nitro-phenyl)-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide CAS Name: N-(2-methyl-5-nitrophenyl)-4-(1-pyrrolidinylsulfonylmethyl)benzamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-4-(pyrrolidinosulfonylmethyl)benzamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC=C(C=C2)CS(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC=C(C=C2)CS(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H21N3O5S/c1-14-4-9-17(22(24)25)12-18(14)20-19(23)16-7-5-15(6-8-16)13-28(26,27)21-10-2-3-11-21/h4-9,12H,2-3,10-11,13H2,1H3,(H,20,23)