2-[2,3-bis(chloranyl)phenyl]sulfonyloxy-5-pyrrolidin-1-ylsulfonyl-benzoic acid

Systemtic Name: 2-[2,3-bis(chloranyl)phenyl]sulfonyloxy-5-pyrrolidin-1-ylsulfonyl-benzoic acid Openeye Name: 2-(2,3-dichlorophenyl)sulfonyloxy-5-pyrrolidin-1-ylsulfonyl-benzoic acid CAS Name: 2-(2,3-dichlorophenyl)sulfonyloxy-5-(1-pyrrolidinylsulfonyl)benzoic acid IUPAC Name: 2-(2,3-dichlorophenyl)sulfonyloxy-5-pyrrolidin-1-ylsulfonylbenzoic acid Traditional Name: 2-(2,3-dichlorophenyl)sulfonyloxy-5-pyrrolidinosulfonyl-benzoic acid Formula: C17H15Cl2NO7S2 MolecularWeight: 480.3395

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OS(=O)(=O)C3=C(C(=CC=C3)Cl)Cl)C(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OS(=O)(=O)C3=C(C(=CC=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C17H15Cl2NO7S2/c18-13-4-3-5-15(16(13)19)29(25,26)27-14-7-6-11(10-12(14)17(21)22)28(23,24)20-8-1-2-9-20/h3-7,10H,1-2,8-9H2,(H,21,22)