[4-(6-hexyl-1,3-benzothiazol-2-yl)phenyl] ethanoate

Systemtic Name: [4-(6-hexyl-1,3-benzothiazol-2-yl)phenyl] ethanoate Openeye Name: [4-(6-hexyl-1,3-benzothiazol-2-yl)phenyl] acetate CAS Name: acetic acid [4-(6-hexyl-1,3-benzothiazol-2-yl)phenyl] ester IUPAC Name: [4-(6-hexyl-1,3-benzothiazol-2-yl)phenyl] acetate Traditional Name: acetic acid [4-(6-hexyl-1,3-benzothiazol-2-yl)phenyl] ester Formula: C21H23NO2S MolecularWeight: 353.47782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)OC(=O)C

Isomeric SMILES

CCCCCCC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)OC(=O)C

InChI

InChI=1S/C21H23NO2S/c1-3-4-5-6-7-16-8-13-19-20(14-16)25-21(22-19)17-9-11-18(12-10-17)24-15(2)23/h8-14H,3-7H2,1-2H3