3-chloranylsulfonyl-4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoic acid

Systemtic Name: 3-chloranylsulfonyl-4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoic acid Openeye Name: 3-chlorosulfonyl-4-[(2-oxopyrrolidin-1-yl)methyl]benzoic acid CAS Name: 3-chlorosulfonyl-4-[(2-oxo-1-pyrrolidinyl)methyl]benzoic acid IUPAC Name: 3-chlorosulfonyl-4-[(2-oxopyrrolidin-1-yl)methyl]benzoic acid Traditional Name: 3-chlorosulfonyl-4-[(2-ketopyrrolidino)methyl]benzoic acid Formula: C12H12ClNO5S MolecularWeight: 317.74538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=C(C=C(C=C2)C(=O)O)S(=O)(=O)Cl

Isomeric SMILES

C1CC(=O)N(C1)CC2=C(C=C(C=C2)C(=O)O)S(=O)(=O)Cl

InChI

InChI=1S/C12H12ClNO5S/c13-20(18,19)10-6-8(12(16)17)3-4-9(10)7-14-5-1-2-11(14)15/h3-4,6H,1-2,5,7H2,(H,16,17)