1-(2-ethylhexanoyl)-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(2-ethylhexanoyl)-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(2-ethylhexanoyl)-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: 1-(2-ethyl-1-oxohexyl)-4-hydroxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-ethylhexanoyl)-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: 1-(2-ethylhexanoyl)-4-hydroxy-proline Formula: C13H23NO4 MolecularWeight: 257.32602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CC(CC1C(=O)O)O

Isomeric SMILES

CCCCC(CC)C(=O)N1CC(CC1C(=O)O)O

InChI

InChI=1S/C13H23NO4/c1-3-5-6-9(4-2)12(16)14-8-10(15)7-11(14)13(17)18/h9-11,15H,3-8H2,1-2H3,(H,17,18)