2-[methylsulfonyl-(3-nitrophenyl)amino]-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]ethanamide

Systemtic Name: 2-[methylsulfonyl-(3-nitrophenyl)amino]-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]ethanamide Openeye Name: 2-(N-methylsulfonyl-3-nitro-anilino)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide CAS Name: 2-(N-methylsulfonyl-3-nitroanilino)-N-[[3-(2-oxo-1-pyrrolidinyl)phenyl]methyl]acetamide IUPAC Name: 2-(N-methylsulfonyl-3-nitroanilino)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide Traditional Name: N-[3-(2-ketopyrrolidino)benzyl]-2-(N-mesyl-3-nitro-anilino)acetamide Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCC1=CC(=CC=C1)N2CCCC2=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCC1=CC(=CC=C1)N2CCCC2=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O6S/c1-31(29,30)23(17-7-3-8-18(12-17)24(27)28)14-19(25)21-13-15-5-2-6-16(11-15)22-10-4-9-20(22)26/h2-3,5-8,11-12H,4,9-10,13-14H2,1H3,(H,21,25)