2-[[3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]propanoic acid

Systemtic Name: 2-[[3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]propanoic acid Openeye Name: 2-[[3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]propanoic acid CAS Name: 2-[[3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]thio]propanoic acid IUPAC Name: 2-[[3-(2-fluorophenyl)-1,2-benzoxazol-6-yl]sulfanyl]propanoic acid Traditional Name: 2-[[3-(2-fluorophenyl)indoxazen-6-yl]thio]propionic acid Formula: C16H12FNO3S MolecularWeight: 317.334783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=CC2=C(C=C1)C(=NO2)C3=CC=CC=C3F

Isomeric SMILES

CC(C(=O)O)SC1=CC2=C(C=C1)C(=NO2)C3=CC=CC=C3F

InChI

InChI=1S/C16H12FNO3S/c1-9(16(19)20)22-10-6-7-12-14(8-10)21-18-15(12)11-4-2-3-5-13(11)17/h2-9H,1H3,(H,19,20)