3-bromanyl-2,5-dimethoxy-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide

Systemtic Name: 3-bromanyl-2,5-dimethoxy-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 3-bromo-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)-2,5-dimethoxy-benzamide CAS Name: 3-bromo-N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]-2,5-dimethoxybenzamide IUPAC Name: 3-bromo-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-2,5-dimethoxybenzamide Traditional Name: 3-bromo-N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)-2,5-dimethoxy-benzamide Formula: C19H21BrN2O6S MolecularWeight: 485.34884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O)OC)Br

Isomeric SMILES

COC1=CC(=C(C(=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)O)OC)Br

InChI

InChI=1S/C19H21BrN2O6S/c1-27-12-9-14(18(28-2)15(20)10-12)19(24)21-16-11-13(5-6-17(16)23)29(25,26)22-7-3-4-8-22/h5-6,9-11,23H,3-4,7-8H2,1-2H3,(H,21,24)