2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-butanoate

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-butanoate Openeye Name: 2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-butanoate CAS Name: 2-(1,3-benzothiazol-2-ylmethyl)-2-ethylbutanoate IUPAC Name: 2-(1,3-benzothiazol-2-ylmethyl)-2-ethylbutanoate Traditional Name: 2-(1,3-benzothiazol-2-ylmethyl)-2-ethyl-butyrate Formula: C14H16NO2S- MolecularWeight: 262.34734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC1=NC2=CC=CC=C2S1)C(=O)[O-]

Isomeric SMILES

CCC(CC)(CC1=NC2=CC=CC=C2S1)C(=O)[O-]

InChI

InChI=1S/C14H17NO2S/c1-3-14(4-2,13(16)17)9-12-15-10-7-5-6-8-11(10)18-12/h5-8H,3-4,9H2,1-2H3,(H,16,17)/p-1