2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-[[2-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]methyl]ethanamide

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-[[2-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]methyl]ethanamide Openeye Name: 2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)-N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]acetamide CAS Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[[2-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methyl]acetamide IUPAC Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[[2-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]acetamide Traditional Name: N-[2-[(2-ketopyrrolidino)methyl]benzyl]-2-(N-mesyl-2-methoxy-5-nitro-anilino)acetamide Formula: C22H26N4O7S MolecularWeight: 490.52944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NCC2=CC=CC=C2CN3CCCC3=O)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NCC2=CC=CC=C2CN3CCCC3=O)S(=O)(=O)C

InChI

InChI=1S/C22H26N4O7S/c1-33-20-10-9-18(26(29)30)12-19(20)25(34(2,31)32)15-21(27)23-13-16-6-3-4-7-17(16)14-24-11-5-8-22(24)28/h3-4,6-7,9-10,12H,5,8,11,13-15H2,1-2H3,(H,23,27)