1,3-benzothiazol-2-ylmethyl 2,2-dimethylpropanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2,2-dimethylpropanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)(C)C(=O)OCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C13H15NO2S/c1-13(2,3)12(15)16-8-11-14-9-6-4-5-7-10(9)17-11/h4-7H,8H2,1-3H3