prop-2-ynyl 2-(2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: prop-2-ynyl 2-(2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate Openeye Name: prop-2-ynyl 2-(2-oxo-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(2-oxo-1,3-benzothiazol-3-yl)acetic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 2-(2-oxo-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(2-keto-1,3-benzothiazol-3-yl)acetic acid propargyl ester Formula: C12H9NO3S MolecularWeight: 247.26976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)CN1C2=CC=CC=C2SC1=O

Isomeric SMILES

C#CCOC(=O)CN1C2=CC=CC=C2SC1=O

InChI

InChI=1S/C12H9NO3S/c1-2-7-16-11(14)8-13-9-5-3-4-6-10(9)17-12(13)15/h1,3-6H,7-8H2