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3-{[6-Chloro-3-(ethoxycarbonyl)-8-methyl-4-quinolinyl]amino}benzoic acid hydrochloride (1:1)

ChemSpider ID: 2069987
Molecular Formula: C₂₀H₁₈Cl₂N₂O₄
Average mass: 421.273895 Da
Monoisotopic mass: 420.064362 Da
Systematic name

3-{[6-Chloro-3-(ethoxycarbonyl)-8-methyl-4-quinolinyl]amino}benzoic acid hydrochloride (1:1)
SMILES and InChIs

SMILES:

Cl.O=C(O)c1cc(ccc1)Nc2c3cc(Cl)cc(c3ncc2C(=O)OCC)C Copied

Std. InChI:

InChI=1S/C20H17ClN2O4.ClH/c1-3-27-20(26)16-10-22-17-11(2)7-13(21)9-15(17)18(16)23-14-6-4-5-12(8-14)19(24)25;/h4-10H,3H2,1-2H3,(H,22,23)(H,24,25);1H Copied

Std. InChIKey:

BQFKIIBLLMWTNM-UHFFFAOYSA-N Copied
Cite this record
CSID:2069987, http://www.chemspider.com/Chemical-Structure.2069987.html (accessed 13:33, May 24, 2013) Copied

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

3-{[6-chloro-3-(ethoxycarbonyl)-8-methyl-4-quinolinyl]amino}benzoic acid hydrochloride

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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