ethyl 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: ethyl 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: ethyl 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid ethyl ester Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCOC(=O)CCCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C13H15NO2S/c1-2-16-13(15)9-5-8-12-14-10-6-3-4-7-11(10)17-12/h3-4,6-7H,2,5,8-9H2,1H3