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2-{2-[(4-Aminobenzyl)amino]-2-oxoethoxy}-5-chlorobenzoate

ChemSpider ID: 21202450
Molecular Formula: C₁₆H₁₄ClN₂O₄
Average mass: 333.747009 Da
Monoisotopic mass: 333.065002 Da
Systematic name

2-{2-[(4-Aminobenzyl)amino]-2-oxoethoxy}-5-chlorobenzoate
SMILES and InChIs

SMILES:

Clc2cc(c(OCC(=O)NCc1ccc(N)cc1)cc2)C([O-])=O Copied

Std. InChI:

InChI=1S/C16H15ClN2O4/c17-11-3-6-14(13(7-11)16(21)22)23-9-15(20)19-8-10-1-4-12(18)5-2-10/h1-7H,8-9,18H2,(H,19,20)(H,21,22)/p-1 Copied

Std. InChIKey:

LPABCXCMCRLRMY-UHFFFAOYSA-M Copied
Cite this record
CSID:21202450, http://www.chemspider.com/Chemical-Structure.21202450.html (accessed 00:56, May 25, 2012) Copied

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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