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

Systemtic Name: 4-chloranyl-2-nitro-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 4-chloro-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-2-nitro-benzamide CAS Name: 4-chloro-N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-2-nitrobenzamide IUPAC Name: 4-chloro-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-2-nitrobenzamide Traditional Name: 4-chloro-N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-2-nitro-benzamide Formula: C17H16ClN3O6S MolecularWeight: 425.84344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3O6S/c18-11-3-5-13(15(9-11)21(24)25)17(23)19-14-10-12(4-6-16(14)22)28(26,27)20-7-1-2-8-20/h3-6,9-10,22H,1-2,7-8H2,(H,19,23)