2-[(5-chloranyl-1,3-dihydroisoindol-2-yl)sulfonyl]propanoic acid

Systemtic Name: 2-[(5-chloranyl-1,3-dihydroisoindol-2-yl)sulfonyl]propanoic acid Openeye Name: 2-(5-chloroisoindolin-2-yl)sulfonylpropanoic acid CAS Name: 2-[(5-chloro-1,3-dihydroisoindol-2-yl)sulfonyl]propanoic acid IUPAC Name: 2-[(5-chloro-1,3-dihydroisoindol-2-yl)sulfonyl]propanoic acid Traditional Name: 2-(5-chloroisoindolin-2-yl)sulfonylpropionic acid Formula: C11H12ClNO4S MolecularWeight: 289.73528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S(=O)(=O)N1CC2=C(C1)C=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)O)S(=O)(=O)N1CC2=C(C1)C=C(C=C2)Cl

InChI

InChI=1S/C11H12ClNO4S/c1-7(11(14)15)18(16,17)13-5-8-2-3-10(12)4-9(8)6-13/h2-4,7H,5-6H2,1H3,(H,14,15)