methyl (2S)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanoate

Systemtic Name: methyl (2S)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanoate Openeye Name: methyl (2S)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanoate CAS Name: (2S)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanoate Traditional Name: (2S)-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)propionic acid methyl ester Formula: C11H11NO5S MolecularWeight: 269.27374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N1C(=O)C2=CC=CC=C2S1(=O)=O

Isomeric SMILES

C[C@@H](C(=O)OC)N1C(=O)C2=CC=CC=C2S1(=O)=O

InChI

InChI=1S/C11H11NO5S/c1-7(11(14)17-2)12-10(13)8-5-3-4-6-9(8)18(12,15)16/h3-7H,1-2H3/t7-/m0/s1