N-[(5-nitro-2-oxidanyl-phenyl)methyl]-5-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide

Systemtic Name: N-[(5-nitro-2-oxidanyl-phenyl)methyl]-5-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)methyl]-5-pyrrolidin-1-ylsulfonyl-furan-2-carboxamide CAS Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-5-(1-pyrrolidinylsulfonyl)-2-furancarboxamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)methyl]-5-pyrrolidin-1-ylsulfonylfuran-2-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-benzyl)-5-pyrrolidinosulfonyl-2-furamide Formula: C16H17N3O7S MolecularWeight: 395.38708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C16H17N3O7S/c20-13-4-3-12(19(22)23)9-11(13)10-17-16(21)14-5-6-15(26-14)27(24,25)18-7-1-2-8-18/h3-6,9,20H,1-2,7-8,10H2,(H,17,21)