3-(Dimethylamino)-1-{3-[2-(4-tertbutoxycarbonylpiperazin-1-yl)ethoxy]phenyl}-prop-2-ene-1-one, NX73799
SKU: NX73799-1G
Product Identifiers
Catalog # | NX73799 |
PubChem CID | 75365558 |
Chemical Name | 3-(Dimethylamino)-1-{3-[2-(4-tertbutoxycarbonylpiperazin-1-yl)ethoxy]phenyl}-prop-2-ene-1-one |
IUPAC Name | tert-butyl 4-[2-[3-[(E)-3-(dimethylamino)prop-2-enoyl]phenoxy]ethyl]piperazine-1-carboxylate |
InChI | InChI=1S/C22H33N3O4/c1-22(2,3)29-21(27)25-13-11-24(12-14-25)15-16-28-19-8-6-7-18(17-19)20(26)9-10-23(4)5/h6-10,17H,11-16H2,1-5H3/b10-9+ |
InChIKey | USLAIYKMCDOXCD-MDZDMXLPSA-N |
SMILES | CN(C)\C=C\C(=O)c1cccc(OCCN2CCN(CC2)C(=O)OC(C)(C)C)c1 |
MDL Number | MFCD11111412 |
Specification
MW | 403.5 |
MF | C22H33N3O4 |
Special Remarks | Mixture of cis/trans isomers |
Manufacturer | Apollo Scientific |
Country of Origin | United Kingdom |