SpectraBase Spectrum ID |
7FScjwiUySh |
Name |
4-(2-Amino-3-cyano-5-oxo-4,5-dihydropyrano[3,2-c] chromen-4-yl)-1-(3-chlorobenzyl)pyridinium chloride |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H17Cl2N3O3 |
InChI |
InChI=1S/C25H17ClN3O3.ClH/c26-17-5-3-4-15(12-17)14-29-10-8-16(9-11-29)21-19(13-27)24(28)32-23-18-6-1-2-7-20(18)31-25(30)22(21)23;/h1-12,21H,14,28H2;1H/q+1;/p-1 |
InChIKey |
KRTRNXPTGZACEK-UHFFFAOYSA-M |
Literature Reference DOI |
10.1016/j.ejmech.2013.07.038 |
Molecular Weight |
478.335 g/mol |
SMILES |
[Cl-].NC1=C(C(c2cc[n+](cc2)Cc2cc(ccc2)Cl)C=2C(Oc3ccccc3C2O1)=O)C#N |
SPLASH |
splash10-0ki6-9630000000-d6ead127b5964fd81e69 |
Source of Spectrum |
EMC-68-267-6f |
Synonyms |
4-(2-amino-3-cyano-5-oxo-4,5-dihydropyrano[3,2-c]chromen-4-yl)-1-(3-chlorobenzyl)pyridin-1-ium chloride
2-Amino-4-[1-[(3-chlorophenyl)methyl]-4-pyridin-1-iumyl]-5-oxo-4H-pyrano[3,2-c][1]benzopyran-3-carbonitrile;chloride
2-Amino-4-[1-[(3-chlorophenyl)methyl]pyridin-1-ium-4-yl]-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile;chloride
2-Azanyl-4-[1-[(3-chlorophenyl)methyl]pyridin-1-ium-4-yl]-5-oxidanylidene-4H-pyrano[3,2-c]chromene-3-carbonitrile;chloride |
Wiley ID |
1755195 |