2,4-bis(chloranyl)-5-(2-pyrrolidin-1-ylethylsulfonyl)benzoic acid

Systemtic Name: 2,4-bis(chloranyl)-5-(2-pyrrolidin-1-ylethylsulfonyl)benzoic acid Openeye Name: 2,4-dichloro-5-(2-pyrrolidin-1-ylethylsulfonyl)benzoic acid CAS Name: 2,4-dichloro-5-[2-(1-pyrrolidinyl)ethylsulfonyl]benzoic acid IUPAC Name: 2,4-dichloro-5-(2-pyrrolidin-1-ylethylsulfonyl)benzoic acid Traditional Name: 2,4-dichloro-5-(2-pyrrolidinoethylsulfonyl)benzoic acid Formula: C13H15Cl2NO4S MolecularWeight: 352.2335

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCS(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl

Isomeric SMILES

C1CCN(C1)CCS(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl

InChI

InChI=1S/C13H15Cl2NO4S/c14-10-8-11(15)12(7-9(10)13(17)18)21(19,20)6-5-16-3-1-2-4-16/h7-8H,1-6H2,(H,17,18)