methyl 2-cyano-2-methyl-1,3-benzothiazole-3-carboxylate

Systemtic Name: methyl 2-cyano-2-methyl-1,3-benzothiazole-3-carboxylate Openeye Name: methyl 2-cyano-2-methyl-1,3-benzothiazole-3-carboxylate CAS Name: 2-cyano-2-methyl-1,3-benzothiazole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-cyano-2-methyl-1,3-benzothiazole-3-carboxylate Traditional Name: 2-cyano-2-methyl-1,3-benzothiazole-3-carboxylic acid methyl ester Formula: C11H10N2O2S MolecularWeight: 234.2743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(N(C2=CC=CC=C2S1)C(=O)OC)C#N

Isomeric SMILES

CC1(N(C2=CC=CC=C2S1)C(=O)OC)C#N

InChI

InChI=1S/C11H10N2O2S/c1-11(7-12)13(10(14)15-2)8-5-3-4-6-9(8)16-11/h3-6H,1-2H3