For research use only. Not for therapeutic Use.
Catalog Number | R054027 |
CAS Number | 1193779-36-0 |
Synonyms | 1-(3,4-Dichlorophenyl)-2-[(1,1-dimethylethyl)amino]-1-propanone (2E)-2-Butenedioate ; |
Molecular Formula | C17H21Cl2NO5 |
Purity | ≥95% |
Storage | Store at RT |
IUPAC Name | (E)-but-2-enedioic acid;2-(tert-butylamino)-1-(3,4-dichlorophenyl)propan-1-one |
InChI | InChI=1S/C13H17Cl2NO.C4H4O4/c1-8(16-13(2,3)4)12(17)9-5-6-10(14)11(15)7-9;5-3(6)1-2-4(7)8/h5-8,16H,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+ |
InChIKey | CUZCRYZSIOLYOO-WLHGVMLRSA-N |
SMILES | CC(C(=O)C1=CC(=C(C=C1)Cl)Cl)NC(C)(C)C.C(=CC(=O)O)C(=O)O |