Vitas-M small molecule compound

1-(4-chlorobutyl)-1H-naphtho[2,3-d][1,2,3]triazole-4,9-dione 2-oxide

Catalog ID
STL573903
SMILES ClCCCCn1[n+]([O-])nc2c1C(=O)c1ccccc1C2=O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C14H12ClN3O3 MW 305.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12ClN3O3/c15-7-3-4-8-17-12-11(16-18(17)21)13(19)9-5-1-2-6-10(9)14(12)20/h1-2,5-6H,3-4,7-8H2
InChIKey
ILJALWYTJAFRNV-UHFFFAOYSA-N
Synonyms

1(4chlorobutyl)1Hnaphtho(23d)(123)triazole49dione2oxide
3(4chlorobutyl)2oxidobenzo(f)benzotriazol2ium49dione
97037327
InChI=1SC14H12ClN3O3c157348171211(1618(17)21)13(19)9512610(9)14(12)20h1256H3478H2
MFCD26098547
ZINC000408710523

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.