2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 2-methylpropanoate

Systemtic Name: 2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 2-methylpropanoate Openeye Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl ester IUPAC Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid 2-(1,1,3-triketo-1,2-benzothiazol-2-yl)ethyl ester Formula: C13H15NO5S MolecularWeight: 297.3269

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCCN1C(=O)C2=CC=CC=C2S1(=O)=O

Isomeric SMILES

CC(C)C(=O)OCCN1C(=O)C2=CC=CC=C2S1(=O)=O

InChI

InChI=1S/C13H15NO5S/c1-9(2)13(16)19-8-7-14-12(15)10-5-3-4-6-11(10)20(14,17)18/h3-6,9H,7-8H2,1-2H3