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

Systemtic Name: (2S,4R)-1-(4-tert-butylphenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4R)-1-(4-tert-butylbenzoyl)-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: (2S,4R)-1-[(4-tert-butylphenyl)-oxomethyl]-4-hydroxy-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4R)-1-(4-tert-butylbenzoyl)-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: (2S,4R)-1-(4-tert-butylbenzoyl)-4-hydroxy-proline Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO4/c1-16(2,3)11-6-4-10(5-7-11)14(19)17-9-12(18)8-13(17)15(20)21/h4-7,12-13,18H,8-9H2,1-3H3,(H,20,21)/t12-,13+/m1/s1