Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 037Y518MHP

Structure

InChI Key SRBJAVRBALKTSV-UHFFFAOYSA-N
Smiles O=C(OCCCC(C)CCC)C(OC1=CC(Cl)=C(Cl)C=C1Cl)C
InChI
1S/C17H23Cl3O3/c1-11(2)7-5-4-6-8-22-17(21)12(3)23-16-10-14(19)13(18)9-15(16)20/h9-12H,4-8H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H23Cl3O3

Cross References

Resources Reference
CAS NUMBER 32534-95-5
NORMAN SUSDAT
FDA SRS 037Y518MHP
PubChem 545619
ChemSpider 474911.0