92521-18-1 Purity
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The PubChem CID of the compound is 77230470.
The molecular formula of the compound is C11H12ClNO3.
The synonyms of the compound are "1-(2-chloro-3-hydroxyphenyl)Proline" and "Proline,1-(2-chloro-3-hydroxyphenyl)-".
The molecular weight of the compound is 241.67 g/mol.
The IUPAC name of the compound is (2S)-1-(2-chloro-3-hydroxyphenyl)pyrrolidine-2-carboxylic acid.
The InChI of the compound is InChI=1S/C11H12ClNO3/c12-10-7(3-1-5-9(10)14)13-6-2-4-8(13)11(15)16/h1,3,5,8,14H,2,4,6H2,(H,15,16)/t8-/m0/s1.
The InChIKey of the compound is VBZHENWFVMPLLB-QMMMGPOBSA-N.
The canonical SMILES of the compound is C1CC(N(C1)C2=C(C(=CC=C2)O)Cl)C(=O)O.
The isomeric SMILES of the compound is C1C[C@H](N(C1)C2=C(C(=CC=C2)O)Cl)C(=O)O.
Yes, the compound is canonicalized.