Pyridinium, 4-[2-(3,4-dihydro-2H-1-benzopyran-6-yl)-5-oxazolyl]-1-(2-isothiocyanatoethyl)-, bromide (1:1)
CAS Registry Number®
155863-02-8
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CAS Name
Pyridinium, 4-[2-(3,4-dihydro-2H-1-benzopyran-6-yl)-5-oxazolyl]-1-(2-isothiocyanatoethyl)-, bromide (1:1)Molecular Formula
C20H18N3O2S.BrCite this Page
Pyridinium, 4-[2-(3,4-dihydro-2H-1-benzopyran-6-yl)-5-oxazolyl]-1-(2-isothiocyanatoethyl)-, bromide (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=155863-02-8 (retrieved ) (CAS RN: 155863-02-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C20H18N3O2S.BrH/c26-14-21-7-10-23-8-5-15(6-9-23)19-13-22-20(25-19)17-3-4-18-16(12-17)2-1-11-24-18;/h3-6,8-9,12-13H,1-2,7,10-11H2;1H/q+1;/p-1
InChIKey
InChIKey=DKHIKMKBZZKQPN-UHFFFAOYSA-M
SMILES
C(CN=C=S)[N+]=1C=CC(C=2OC(=NC2)C=3C=C4C(=CC3)OCCC4)=CC1.[Br-]
Canonical SMILES
[Br-].S=C=NCC[N+]=1C=CC(=CC1)C=2OC(=NC2)C=3C=CC=4OCCCC4C3
Other Names for this Substance
- Pyridinium, 4-[2-(3,4-dihydro-2H-1-benzopyran-6-yl)-5-oxazolyl]-1-(2-isothiocyanatoethyl)-, bromide (1:1)
- Pyridinium, 4-[2-(3,4-dihydro-2H-1-benzopyran-6-yl)-5-oxazolyl]-1-(2-isothiocyanatoethyl)-, bromide
