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

Systemtic Name: 3-nitro-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-3-nitro-benzamide CAS Name: N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-3-nitrobenzamide IUPAC Name: N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-nitrobenzamide Traditional Name: N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-3-nitro-benzamide Formula: C17H17N3O6S MolecularWeight: 391.39838

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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(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O6S/c21-16-7-6-14(27(25,26)19-8-1-2-9-19)11-15(16)18-17(22)12-4-3-5-13(10-12)20(23)24/h3-7,10-11,21H,1-2,8-9H2,(H,18,22)