(2S)-1-[(E,2R)-2,4-dimethyl-3-oxidanyl-dodec-4-enoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(E,2R)-2,4-dimethyl-3-oxidanyl-dodec-4-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(E,2R)-3-hydroxy-2,4-dimethyl-dodec-4-enoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(E,2R)-3-hydroxy-2,4-dimethyl-1-oxododec-4-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(E,2R)-3-hydroxy-2,4-dimethyldodec-4-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(E,2R)-3-hydroxy-2,4-dimethyl-dodec-4-enoyl]proline Formula: C19H33NO4 MolecularWeight: 339.46962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=C(C)C(C(C)C(=O)N1CCCC1C(=O)O)O

Isomeric SMILES

CCCCCCC/C=C(\C)/C([C@@H](C)C(=O)N1CCC[C@H]1C(=O)O)O

InChI

InChI=1S/C19H33NO4/c1-4-5-6-7-8-9-11-14(2)17(21)15(3)18(22)20-13-10-12-16(20)19(23)24/h11,15-17,21H,4-10,12-13H2,1-3H3,(H,23,24)/b14-11+/t15-,16+,17?/m1/s1