2-(2-Chloro-10H-phenothiazin-10-yl)-2-oxoethyl 2-(methylsulfonyl)benzoate

ChemSpider ID: 23757575
Molecular Formula: C₂₂H₁₆ClNO₅S₂
Average mass: 473.949097 Da
Monoisotopic mass: 473.015839 Da
Systematic name

2-(2-Chloro-10H-phenothiazin-10-yl)-2-oxoethyl 2-(methylsulfonyl)benzoate
SMILES and InChIs

SMILES:

CS(=O)(=O)c1ccccc1C(=O)OCC(=O)N2c3ccccc3Sc4c2cc(cc4)Cl Copied

Std. InChI:

InChI=1S/C22H16ClNO5S2/c1-31(27,28)20-9-5-2-6-15(20)22(26)29-13-21(25)24-16-7-3-4-8-18(16)30-19-11-10-14(23)12-17(19)24/h2-12H,13H2,1H3 Copied

Std. InChIKey:

CIXBZWIVDQWFKJ-UHFFFAOYSA-N Copied
Cite this record
CSID:23757575, http://www.chemspider.com/Chemical-Structure.23757575.html (accessed 10:01, May 25, 2012) Copied

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

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