N-(2-methoxy-4-nitro-phenyl)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-(2-methoxy-4-nitrophenyl)-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide Formula: C16H17N3O6S2 MolecularWeight: 411.45268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2CCCN2S(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2CCCN2S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H17N3O6S2/c1-25-14-10-11(19(21)22)6-7-12(14)17-16(20)13-4-2-8-18(13)27(23,24)15-5-3-9-26-15/h3,5-7,9-10,13H,2,4,8H2,1H3,(H,17,20)