2-ethyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: 2-ethyl-1,3-benzothiazole-6-carboxylate Openeye Name: 2-ethyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-ethyl-1,3-benzothiazole-6-carboxylate IUPAC Name: 2-ethyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-ethyl-1,3-benzothiazole-6-carboxylate Formula: C10H8NO2S- MolecularWeight: 206.24102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(S1)C=C(C=C2)C(=O)[O-]

Isomeric SMILES

CCC1=NC2=C(S1)C=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C10H9NO2S/c1-2-9-11-7-4-3-6(10(12)13)5-8(7)14-9/h3-5H,2H2,1H3,(H,12,13)/p-1