(2S,4R)-1-(4-methoxy-2-oxidanyl-phenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4R)-1-(4-methoxy-2-oxidanyl-phenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4R)-4-hydroxy-1-(2-hydroxy-4-methoxy-benzoyl)pyrrolidine-2-carboxylic acid CAS Name: (2S,4R)-4-hydroxy-1-[(2-hydroxy-4-methoxyphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4R)-4-hydroxy-1-(2-hydroxy-4-methoxybenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S,4R)-4-hydroxy-1-(2-hydroxy-4-methoxy-benzoyl)proline Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N2CC(CC2C(=O)O)O)O

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N2C[C@@H](C[C@H]2C(=O)O)O)O

InChI

InChI=1S/C13H15NO6/c1-20-8-2-3-9(11(16)5-8)12(17)14-6-7(15)4-10(14)13(18)19/h2-3,5,7,10,15-16H,4,6H2,1H3,(H,18,19)/t7-,10+/m1/s1