CAS Registry Number: 117836-26-7

Name:

1,​2-​Piperidinedicarboxyl​ic acid, 5-​hydroxy-​, 2-​methyl 1-​(phenylmethyl) ester, (2S,​5S)​-
1,​2-​Piperidinedicarboxyl​ic acid, 5-​hydroxy-​, 2-​methyl 1-​(phenylmethyl) ester, (2S-​cis)​- 

Chemical Formula: C15H19NO5
Exact Mass: 293.13
Molecular Weight: 293.32
m/z: 293.13 (100.0%), 294.13 (16.6%), 295.13 (2.3%)

InChI: InChI=1S/C15H19NO5/c1-20-14(18)13-8-7-12(17)9-16(13)15(19)21-10-11-5-3-2-4-6-11/h2-6,12-13,17H,7-10H2,1H3/t12-,13-/m0/s1
InChIKey: NLHXFVLVIIBQOM-STQMWFEESA-N
Canonical SMILES : COC(=O)C1CCC(CN1C(=O)OCC2=CC=CC=C2)O
Isomeric SMILES: COC(=O)[C@@H]1CC[C@@H](CN1C(=O)OCC2=CC=CC=C2)O

Specification

98%

Journal of Organic Chemistry (2005), 70(17), 6956-6959.                                 

Tetrahedron (2004), 60(42), 9485-9491.