Chemical Component Summary

Name{(3R,5R,6S)-5-(3-chlorophenyl)-6-(4-chlorophenyl)-1-[(2S)-1-hydroxybutan-2-yl]-2-oxopiperidin-3-yl}acetic acid
Identifiers2-[(3R,5R,6S)-5-(3-chlorophenyl)-6-(4-chlorophenyl)-1-[(2S)-1-oxidanylbutan-2-yl]-2-oxidanylidene-piperidin-3-yl]ethanoic acid
FormulaC23 H25 Cl2 N O4
Molecular Weight450.355
TypeNON-POLYMER
Isomeric SMILESCC[C@@H](CO)N1[C@@H]([C@H](C[C@@H](C1=O)CC(=O)O)c2cccc(c2)Cl)c3ccc(cc3)Cl
InChIInChI=1S/C23H25Cl2NO4/c1-2-19(13-27)26-22(14-6-8-17(24)9-7-14)20(15-4-3-5-18(25)10-15)11-16(23(26)30)12-21(28)29/h3-10,16,19-20,22,27H,2,11-13H2,1H3,(H,28,29)/t16-,19+,20-,22-/m1/s1
InChIKeyMUYVUHCWOCMQPD-CJXUKZFBSA-N

Chemical Details

Formal Charge0
Atom Count55
Chiral Atom Count4
Bond Count57
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 56591282