1-(5-chloranyl-4-iodanyl-2-methoxy-phenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(5-chloranyl-4-iodanyl-2-methoxy-phenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(5-chloro-4-iodo-2-methoxy-benzoyl)-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-chloro-4-iodo-2-methoxyphenyl)-oxomethyl]-4-hydroxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(5-chloro-4-iodo-2-methoxybenzoyl)-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: 1-(5-chloro-4-iodo-2-methoxy-benzoyl)-4-hydroxy-proline Formula: C13H13ClINO5 MolecularWeight: 425.60349

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)N2CC(CC2C(=O)O)O)Cl)I

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)N2CC(CC2C(=O)O)O)Cl)I

InChI

InChI=1S/C13H13ClINO5/c1-21-11-4-9(15)8(14)3-7(11)12(18)16-5-6(17)2-10(16)13(19)20/h3-4,6,10,17H,2,5H2,1H3,(H,19,20)