sodium 2-methyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: sodium 2-methyl-1,3-benzothiazole-6-carboxylate Openeye Name: sodium 2-methyl-1,3-benzothiazole-6-carboxylate CAS Name: sodium 2-methyl-1,3-benzothiazole-6-carboxylate IUPAC Name: sodium 2-methyl-1,3-benzothiazole-6-carboxylate Traditional Name: sodium 2-methyl-1,3-benzothiazole-6-carboxylate Formula: C9H6NNaO2S MolecularWeight: 215.20421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)C(=O)[O-].[Na+]

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)C(=O)[O-].[Na+]

InChI

InChI=1S/C9H7NO2S.Na/c1-5-10-7-3-2-6(9(11)12)4-8(7)13-5;/h2-4H,1H3,(H,11,12);/q;+1/p-1