2-[2-(propan-2-yloxymethyl)-1,3-benzothiazol-6-yl]ethanoate

Systemtic Name: 2-[2-(propan-2-yloxymethyl)-1,3-benzothiazol-6-yl]ethanoate Openeye Name: 2-[2-(isopropoxymethyl)-1,3-benzothiazol-6-yl]acetate CAS Name: 2-[2-(propan-2-yloxymethyl)-1,3-benzothiazol-6-yl]acetate IUPAC Name: 2-[2-(propan-2-yloxymethyl)-1,3-benzothiazol-6-yl]acetate Traditional Name: 2-[2-(isopropoxymethyl)-1,3-benzothiazol-6-yl]acetate Formula: C13H14NO3S- MolecularWeight: 264.32016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=NC2=C(S1)C=C(C=C2)CC(=O)[O-]

Isomeric SMILES

CC(C)OCC1=NC2=C(S1)C=C(C=C2)CC(=O)[O-]

InChI

InChI=1S/C13H15NO3S/c1-8(2)17-7-12-14-10-4-3-9(6-13(15)16)5-11(10)18-12/h3-5,8H,6-7H2,1-2H3,(H,15,16)/p-1