For research use only. Not for therapeutic Use.
Catalog Number | R054443 |
CAS Number | 949141-22-4 |
Synonyms | (11E)-11-[3-(Dimethylamino)propylidene]-6,11-dihydrodibenz[b,e]oxepin-2-acetic Acid Hydrochloride; |
Molecular Formula | C21H24ClNO3 |
Purity | ≥95% |
Storage | Desiccate at RT |
IUPAC Name | 2-[(11E)-11-[3-(dimethylamino)propylidene]-6H-benzo[c][1]benzoxepin-2-yl]acetic acid;hydrochloride |
InChI | InChI=1S/C21H23NO3.ClH/c1-22(2)11-5-8-18-17-7-4-3-6-16(17)14-25-20-10-9-15(12-19(18)20)13-21(23)24;/h3-4,6-10,12H,5,11,13-14H2,1-2H3,(H,23,24);1H/b18-8+; |
InChIKey | HVRLZEKDTUEKQH-JUIXXEQESA-N |
SMILES | CN(C)CCC=C1C2=CC=CC=C2COC3=C1C=C(C=C3)CC(=O)O.Cl |