3-[3-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]phenoxy]propanoic acid

Systemtic Name: 3-[3-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]phenoxy]propanoic acid Openeye Name: 3-[3-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]phenoxy]propanoic acid CAS Name: 3-[3-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]phenoxy]propanoic acid IUPAC Name: 3-[3-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]phenoxy]propanoic acid Traditional Name: 3-[3-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]phenoxy]propionic acid Formula: C18H15NO3S MolecularWeight: 325.3816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C=CC3=CC(=CC=C3)OCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C=C/C3=CC(=CC=C3)OCCC(=O)O

InChI

InChI=1S/C18H15NO3S/c20-18(21)10-11-22-14-5-3-4-13(12-14)8-9-17-19-15-6-1-2-7-16(15)23-17/h1-9,12H,10-11H2,(H,20,21)/b9-8+