3-(3,4-dihydro-2H-thiochromen-8-yloxy)propanoic acid

Systemtic Name: 3-(3,4-dihydro-2H-thiochromen-8-yloxy)propanoic acid Openeye Name: 3-thiochroman-8-yloxypropanoic acid CAS Name: 3-(3,4-dihydro-2H-1-benzothiopyran-8-yloxy)propanoic acid IUPAC Name: 3-(3,4-dihydro-2H-thiochromen-8-yloxy)propanoic acid Traditional Name: 3-thiochroman-8-yloxypropionic acid Formula: C12H14O3S MolecularWeight: 238.30276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=CC=C2)OCCC(=O)O)SC1

Isomeric SMILES

C1CC2=C(C(=CC=C2)OCCC(=O)O)SC1

InChI

InChI=1S/C12H14O3S/c13-11(14)6-7-15-10-5-1-3-9-4-2-8-16-12(9)10/h1,3,5H,2,4,6-8H2,(H,13,14)