1,3-benzothiazol-2-ylmethyl 3-acetamidopropanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-acetamidopropanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-acetamidopropanoate CAS Name: 3-acetamidopropanoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-acetamidopropanoate Traditional Name: 3-acetamidopropionic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O3S/c1-9(16)14-7-6-13(17)18-8-12-15-10-4-2-3-5-11(10)19-12/h2-5H,6-8H2,1H3,(H,14,16)