N-Benzyl-2-(1,1,3-trioxo-1,3-dihydro-2H-1,2-benzisothiazol-2-yl)acetamide

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Systematic / IUPAC Name: N-Benzyl-2-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)acetamide

ID: Reference5210

Other Names: N-Benzyl-2-(1,1-dioxido-3-oxobenzo[d]isothiazol-2(3H)-yl)acetamide;
1,2-Benzisothiazole-2(3H)-acetamide, 3-oxo-N-(phenylmethyl), 1,1-dioxide

Formula: C16H14N2O4S

Spectral Data

N-Benzyl-2-(1,1,3-trioxo-1,3-dihydro-2H-1,2-benzisothiazol-2-yl)acetamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 213
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 7/20/2016 12:43:46 PM
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Identificators

InChI InChI=1S/C16H14N2O4S/c19-15(17-10-12-6-2-1-3-7-12)11-18-16(20)13-8-4-5-9-14(13)23(18,21)22/h1-9H,10-11H2,(H,17,19)
InChI Key JOMGEJMZXGVLDW-UHFFFAOYSA-N
Canonical SMILES C1=CC=C(C=C1)CNC(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O
CAS
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Other Names N-Benzyl-2-(1,1-dioxido-3-oxobenzo[d]isothiazol-2(3H)-yl)acetamide;
1,2-Benzisothiazole-2(3H)-acetamide, 3-oxo-N-(phenylmethyl), 1,1-dioxide

In Other Databases

ChemSpider 643357
PubChem 736227