1-(4-iodophenyl)sulfonyl-4-methoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(4-iodophenyl)sulfonyl-4-methoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-(4-iodophenyl)sulfonyl-4-methoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-(4-iodophenyl)sulfonyl-4-methoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(4-iodophenyl)sulfonyl-4-methoxypyrrolidine-2-carboxylic acid Traditional Name: 1-(4-iodophenyl)sulfonyl-4-methoxy-proline Formula: C12H14INO5S MolecularWeight: 411.21273

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)I)C(=O)O

Isomeric SMILES

COC1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)I)C(=O)O

InChI

InChI=1S/C12H14INO5S/c1-19-9-6-11(12(15)16)14(7-9)20(17,18)10-4-2-8(13)3-5-10/h2-5,9,11H,6-7H2,1H3,(H,15,16)