rel-(+)-(2E,4E)-1-[(2R,5S)-2,4,5-Trimethyl-1-piperazinyl]-2,4-hexadien-1-one
CAS Registry Number®
24779-38-2
CAS Name
rel-(+)-(2E,4E)-1-[(2R,5S)-2,4,5-Trimethyl-1-piperazinyl]-2,4-hexadien-1-oneMolecular Formula
C13H22N2OMolecular Mass
222.33Cite this Page
rel-(+)-(2E,4E)-1-[(2R,5S)-2,4,5-Trimethyl-1-piperazinyl]-2,4-hexadien-1-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=24779-38-2 (retrieved ) (CAS RN: 24779-38-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1/C13H22N2O/c1-5-6-7-8-13(16)15-10-11(2)14(4)9-12(15)3/h5-8,11-12H,9-10H2,1-4H3/b6-5+,8-7+/t11-,12+/s2
InChIKey
InChIKey=DVCNHRTYSUTLOS-KNNRPPFRNA-N
SMILES
C(/C=C/C=C/C)(=O)N1[C@H](C)CN(C)[C@@H](C)C1
Canonical SMILES
O=C(C=CC=CC)N1CC(N(C)CC1C)C
Other Names for this Substance
- 2,4-Hexadien-1-one, 1-[(2R,5S)-2,4,5-trimethyl-1-piperazinyl]-, (2E,4E)-rel-(+)-
- Nigragilline
- Piperazine, 1,2,5-trimethyl-4-(1-oxo-2,4-hexadienyl)-, [2α,4(E,E),5β]-(+)-
- Piperazine, 1,2,5-trimethyl-4-[(2E,4E)-1-oxo-2,4-hexadienyl]-, (2R,5S)-rel-(+)-
- rel-(+)-(2E,4E)-1-[(2R,5S)-2,4,5-Trimethyl-1-piperazinyl]-2,4-hexadien-1-one