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

Systemtic Name: ethyl (2S)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanoate Openeye Name: ethyl (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 ethyl ester IUPAC Name: ethyl (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 ethyl ester Formula: C12H13NO5S MolecularWeight: 283.30032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO5S/c1-3-18-12(15)8(2)13-11(14)9-6-4-5-7-10(9)19(13,16)17/h4-8H,3H2,1-2H3/t8-/m0/s1