Benzoxazolium, 3-pentyl-2-[5-(3-pentyl-2(3H)-benzoxazolylidene)-1,3-pentadien-1-yl]-, iodide (1:1)
CAS Registry Number®
53213-92-6
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CAS Name
Benzoxazolium, 3-pentyl-2-[5-(3-pentyl-2(3H)-benzoxazolylidene)-1,3-pentadien-1-yl]-, iodide (1:1)Molecular Formula
C29H35N2O2.ICite this Page
Benzoxazolium, 3-pentyl-2-[5-(3-pentyl-2(3H)-benzoxazolylidene)-1,3-pentadien-1-yl]-, iodide (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=53213-92-6 (retrieved ) (CAS RN: 53213-92-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C29H35N2O2.HI/c1-3-5-14-22-30-24-16-10-12-18-26(24)32-28(30)20-8-7-9-21-29-31(23-15-6-4-2)25-17-11-13-19-27(25)33-29;/h7-13,16-21H,3-6,14-15,22-23H2,1-2H3;1H/q+1;/p-1
InChIKey
InChIKey=WSRFDTBIGBFQOK-UHFFFAOYSA-M
SMILES
C(CCCC)N1C=2C(OC1=CC=CC=CC3=[N+](CCCCC)C=4C(O3)=CC=CC4)=CC=CC2.[I-]
Canonical SMILES
[I-].O1C=2C=CC=CC2N(C1=CC=CC=CC=3OC=4C=CC=CC4[N+]3CCCCC)CCCCC
Other Names for this Substance
- Benzoxazolium, 3-pentyl-2-[5-(3-pentyl-2(3H)-benzoxazolylidene)-1,3-pentadien-1-yl]-, iodide (1:1)
- Benzoxazolium, 3-pentyl-2-[5-(3-pentyl-2(3H)-benzoxazolylidene)-1,3-pentadienyl]-, iodide
- 3-Pentyl-2-(5-(3-pentylbenzo[d]oxazol-2(3H)-ylidene)penta-1,3-dien-1-yl)-3H-benzo[d]oxazol-1-ium iodide
