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Diethyl 2-((4-((3-(ethoxycarbonyl)-7-(trifluoromethyl)-2-quinoxalinyl)amino)benzoyl)amino)pentanedioate

ChemSpider ID: 340195
Molecular Formula: C₂₈H₂₉F₃N₄O₇
Average mass: 590.547729 Da
Monoisotopic mass: 590.198853 Da
Systematic name

Diethyl N-(4-{[3-(ethoxycarbonyl)-7-(trifluoromethyl)-2-quinoxalinyl]amino}benzoyl)glutamate
SMILES and InChIs

SMILES:

O=C(OCC)C(NC(=O)c1ccc(cc1)Nc2nc3cc(ccc3nc2C(=O)OCC)C(F)(F)F)CCC(=O)OCC Copied

Std. InChI:

InChI=1S/C28H29F3N4O7/c1-4-40-22(36)14-13-20(26(38)41-5-2)35-25(37)16-7-10-18(11-8-16)32-24-23(27(39)42-6-3)33-19-12-9-17(28(29,30)31)15-21(19)34-24/h7-12,15,20H,4-6,13-14H2,1-3H3,(H,32,34)(H,35,37) Copied

Std. InChIKey:

NJFOSEYKVHPKKA-UHFFFAOYSA-N Copied
Cite this record
CSID:340195, http://www.chemspider.com/Chemical-Structure.340195.html (accessed 13:31, May 23, 2013) Copied

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

Diethyl 2-((4-((3-(ethoxycarbonyl)-7-(trifluoromethyl)-2-quinoxalinyl)amino)benzoyl)amino)pentanedioate

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

AIDS146312 [DBID]

AIDS-146312 [DBID]

NCI60_025827 [DBID]

NSC672883 [DBID]

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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