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

Systemtic Name: (2S,4R)-1-(2-methylphenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4R)-4-hydroxy-1-(2-methylbenzoyl)pyrrolidine-2-carboxylic acid CAS Name: (2S,4R)-4-hydroxy-1-[(2-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4R)-4-hydroxy-1-(2-methylbenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S,4R)-4-hydroxy-1-o-toluoyl-proline Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CC(CC2C(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2C[C@@H](C[C@H]2C(=O)O)O

InChI

InChI=1S/C13H15NO4/c1-8-4-2-3-5-10(8)12(16)14-7-9(15)6-11(14)13(17)18/h2-5,9,11,15H,6-7H2,1H3,(H,17,18)/t9-,11+/m1/s1