3-[2-(3-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]propanoic acid

Systemtic Name: 3-[2-(3-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]propanoic acid Openeye Name: 3-[2-(3-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]propanoic acid CAS Name: 3-[2-(3-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]propanoic acid IUPAC Name: 3-[2-(3-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]propanoic acid Traditional Name: 3-[2-(3-fluorophenyl)-5-methyl-1,2,4-triazol-3-yl]propionic acid Formula: C12H12FN3O2 MolecularWeight: 249.240983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N1)CCC(=O)O)C2=CC(=CC=C2)F

Isomeric SMILES

CC1=NN(C(=N1)CCC(=O)O)C2=CC(=CC=C2)F

InChI

InChI=1S/C12H12FN3O2/c1-8-14-11(5-6-12(17)18)16(15-8)10-4-2-3-9(13)7-10/h2-4,7H,5-6H2,1H3,(H,17,18)