2-(6-phenyl-1,3-benzothiazol-5-yl)propanoic acid

Systemtic Name: 2-(6-phenyl-1,3-benzothiazol-5-yl)propanoic acid Openeye Name: 2-(6-phenyl-1,3-benzothiazol-5-yl)propanoic acid CAS Name: 2-(6-phenyl-1,3-benzothiazol-5-yl)propanoic acid IUPAC Name: 2-(6-phenyl-1,3-benzothiazol-5-yl)propanoic acid Traditional Name: 2-(6-phenyl-1,3-benzothiazol-5-yl)propionic acid Formula: C16H13NO2S MolecularWeight: 283.34492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1C3=CC=CC=C3)SC=N2)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1C3=CC=CC=C3)SC=N2)C(=O)O

InChI

InChI=1S/C16H13NO2S/c1-10(16(18)19)12-7-14-15(20-9-17-14)8-13(12)11-5-3-2-4-6-11/h2-10H,1H3,(H,18,19)