2-bromanyl-5-pyrrolidin-1-ylsulfonyl-benzoic acid

Systemtic Name: 2-bromanyl-5-pyrrolidin-1-ylsulfonyl-benzoic acid Openeye Name: 2-bromo-5-pyrrolidin-1-ylsulfonyl-benzoic acid CAS Name: 2-bromo-5-(1-pyrrolidinylsulfonyl)benzoic acid IUPAC Name: 2-bromo-5-pyrrolidin-1-ylsulfonylbenzoic acid Traditional Name: 2-bromo-5-pyrrolidinosulfonyl-benzoic acid Formula: C11H12BrNO4S MolecularWeight: 334.18628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C11H12BrNO4S/c12-10-4-3-8(7-9(10)11(14)15)18(16,17)13-5-1-2-6-13/h3-4,7H,1-2,5-6H2,(H,14,15)