3-[(8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]propanoic acid

Systemtic Name: 3-[(8-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)amino]propanoic acid Openeye Name: 3-[(8-fluorothiochroman-4-yl)amino]propanoic acid CAS Name: 3-[(8-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)amino]propanoic acid IUPAC Name: 3-[(8-fluoro-3,4-dihydro-2H-thiochromen-4-yl)amino]propanoic acid Traditional Name: 3-[(8-fluorothiochroman-4-yl)amino]propionic acid Formula: C12H14FNO2S MolecularWeight: 255.308463

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NCCC(=O)O)C=CC=C2F

Isomeric SMILES

C1CSC2=C(C1NCCC(=O)O)C=CC=C2F

InChI

InChI=1S/C12H14FNO2S/c13-9-3-1-2-8-10(5-7-17-12(8)9)14-6-4-11(15)16/h1-3,10,14H,4-7H2,(H,15,16)