2-[2-(phenylmethyl)-1,3-benzothiazol-6-yl]ethanoate

Systemtic Name: 2-[2-(phenylmethyl)-1,3-benzothiazol-6-yl]ethanoate Openeye Name: 2-(2-benzyl-1,3-benzothiazol-6-yl)acetate CAS Name: 2-[2-(phenylmethyl)-1,3-benzothiazol-6-yl]acetate IUPAC Name: 2-(2-benzyl-1,3-benzothiazol-6-yl)acetate Traditional Name: 2-(2-benzyl-1,3-benzothiazol-6-yl)acetate Formula: C16H12NO2S- MolecularWeight: 282.33698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC3=C(S2)C=C(C=C3)CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC3=C(S2)C=C(C=C3)CC(=O)[O-]

InChI

InChI=1S/C16H13NO2S/c18-16(19)10-12-6-7-13-14(8-12)20-15(17-13)9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,18,19)/p-1