methyl 3-(5-methyl-1,2-benzothiazol-3-yl)propanoate

Systemtic Name: methyl 3-(5-methyl-1,2-benzothiazol-3-yl)propanoate Openeye Name: methyl 3-(5-methyl-1,2-benzothiazol-3-yl)propanoate CAS Name: 3-(5-methyl-1,2-benzothiazol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(5-methyl-1,2-benzothiazol-3-yl)propanoate Traditional Name: 3-(5-methyl-1,2-benzothiazol-3-yl)propionic acid methyl ester Formula: C12H13NO2S MolecularWeight: 235.30212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SN=C2CCC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)SN=C2CCC(=O)OC

InChI

InChI=1S/C12H13NO2S/c1-8-3-5-11-9(7-8)10(13-16-11)4-6-12(14)15-2/h3,5,7H,4,6H2,1-2H3