ethyl 2-(1,3-benzothiazol-2-yl)-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(1,3-benzothiazol-2-yl)-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(1,3-benzothiazol-2-yl)-3-oxo-butanoate CAS Name: 2-(1,3-benzothiazol-2-yl)-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzothiazol-2-yl)-3-oxobutanoate Traditional Name: 2-(1,3-benzothiazol-2-yl)-3-keto-butyric acid ethyl ester Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=NC2=CC=CC=C2S1)C(=O)C

Isomeric SMILES

CCOC(=O)C(C1=NC2=CC=CC=C2S1)C(=O)C

InChI

InChI=1S/C13H13NO3S/c1-3-17-13(16)11(8(2)15)12-14-9-6-4-5-7-10(9)18-12/h4-7,11H,3H2,1-2H3