2,4-bis(chloranyl)-5-[4-(2-oxidanylidenepyrrolidin-1-yl)phenoxy]sulfonyl-benzoic acid

Systemtic Name: 2,4-bis(chloranyl)-5-[4-(2-oxidanylidenepyrrolidin-1-yl)phenoxy]sulfonyl-benzoic acid Openeye Name: 2,4-dichloro-5-[4-(2-oxopyrrolidin-1-yl)phenoxy]sulfonyl-benzoic acid CAS Name: 2,4-dichloro-5-[4-(2-oxo-1-pyrrolidinyl)phenoxy]sulfonylbenzoic acid IUPAC Name: 2,4-dichloro-5-[4-(2-oxopyrrolidin-1-yl)phenoxy]sulfonylbenzoic acid Traditional Name: 2,4-dichloro-5-[4-(2-ketopyrrolidino)phenoxy]sulfonyl-benzoic acid Formula: C17H13Cl2NO6S MolecularWeight: 430.25922

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)OS(=O)(=O)C3=C(C=C(C(=C3)C(=O)O)Cl)Cl

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)OS(=O)(=O)C3=C(C=C(C(=C3)C(=O)O)Cl)Cl

InChI

InChI=1S/C17H13Cl2NO6S/c18-13-9-14(19)15(8-12(13)17(22)23)27(24,25)26-11-5-3-10(4-6-11)20-7-1-2-16(20)21/h3-6,8-9H,1-2,7H2,(H,22,23)