N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C21H24FN3O7S MolecularWeight: 481.494563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2CCCN2S(=O)(=O)C3=CC=CC=C3F)[N+](=O)[O-])OC

InChI

InChI=1S/C21H24FN3O7S/c1-31-18-12-14(17(25(27)28)13-19(18)32-2)9-10-23-21(26)16-7-5-11-24(16)33(29,30)20-8-4-3-6-15(20)22/h3-4,6,8,12-13,16H,5,7,9-11H2,1-2H3,(H,23,26)