2-tert-butyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: 2-tert-butyl-1,3-benzothiazole-6-carboxylate Openeye Name: 2-tert-butyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-tert-butyl-1,3-benzothiazole-6-carboxylate IUPAC Name: 2-tert-butyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-tert-butyl-1,3-benzothiazole-6-carboxylate Formula: C12H12NO2S- MolecularWeight: 234.29418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(S1)C=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NC2=C(S1)C=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C12H13NO2S/c1-12(2,3)11-13-8-5-4-7(10(14)15)6-9(8)16-11/h4-6H,1-3H3,(H,14,15)/p-1