4-nitro-3-oxidanyl-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide

Systemtic Name: 4-nitro-3-oxidanyl-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 3-hydroxy-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-4-nitro-benzamide CAS Name: 3-hydroxy-N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-4-nitrobenzamide IUPAC Name: 3-hydroxy-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-4-nitrobenzamide Traditional Name: 3-hydroxy-N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-4-nitro-benzamide Formula: C17H17N3O7S MolecularWeight: 407.39778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O7S/c21-15-6-4-12(28(26,27)19-7-1-2-8-19)10-13(15)18-17(23)11-3-5-14(20(24)25)16(22)9-11/h3-6,9-10,21-22H,1-2,7-8H2,(H,18,23)