(2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]propanoic acid

Systemtic Name: (2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]propanoic acid Openeye Name: (2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]propanoic acid CAS Name: (2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]propanoic acid IUPAC Name: (2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]propanoic acid Traditional Name: (2S)-2-[4-(1,3-benzothiazol-2-yl)phenoxy]propionic acid Formula: C16H13NO3S MolecularWeight: 299.34432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@@H](C(=O)O)OC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H13NO3S/c1-10(16(18)19)20-12-8-6-11(7-9-12)15-17-13-4-2-3-5-14(13)21-15/h2-10H,1H3,(H,18,19)/t10-/m0/s1