2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide Openeye Name: 2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide CAS Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[4-(2-oxo-1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide Traditional Name: N-[4-(2-ketopyrrolidino)phenyl]-2-(N-mesyl-2-methoxy-5-nitro-anilino)acetamide Formula: C20H22N4O7S MolecularWeight: 462.47628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC=C(C=C2)N3CCCC3=O)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC=C(C=C2)N3CCCC3=O)S(=O)(=O)C

InChI

InChI=1S/C20H22N4O7S/c1-31-18-10-9-16(24(27)28)12-17(18)23(32(2,29)30)13-19(25)21-14-5-7-15(8-6-14)22-11-3-4-20(22)26/h5-10,12H,3-4,11,13H2,1-2H3,(H,21,25)