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1-(3-Methylphenyl)-4-[(3-methylphenyl)amino]-1H-1,2,4-triazol-4-ium chloride

ChemSpider ID: 173605
Molecular Formula: C₁₆H₁₇ClN₄
Average mass: 300.786011 Da
Monoisotopic mass: 300.114166 Da
Systematic name

1-(3-Methylphenyl)-4-[(3-methylphenyl)amino]-1H-1,2,4-triazol-4-ium chloride
SMILES and InChIs

SMILES:

[Cl-].n1c[n+](cn1c2cccc(c2)C)Nc3cc(ccc3)C Copied

Std. InChI:

InChI=1S/C16H17N4.ClH/c1-13-5-3-7-15(9-13)18-19-11-17-20(12-19)16-8-4-6-14(2)10-16;/h3-12,18H,1-2H3;1H/q+1;/p-1 Copied

Std. InChIKey:

SCFIWKJHTNWKPJ-UHFFFAOYSA-M Copied
Cite this record
CSID:173605, http://www.chemspider.com/Chemical-Structure.173605.html (accessed 18:56, May 25, 2013) Copied

Validated by Experts, Validated by Users, Non-Validated, Removed by Users, Redirected by Users, Redirect Approved by Experts

2240-97-3 [RN]

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

Click to predict properties on the Chemicalize site

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