(5-methyl-3-oxidanylidene-1H-1,2,4-triazol-2-yl) 3-(4-fluorophenyl)propanoate

Systemtic Name: (5-methyl-3-oxidanylidene-1H-1,2,4-triazol-2-yl) 3-(4-fluorophenyl)propanoate Openeye Name: (5-methyl-3-oxo-1H-1,2,4-triazol-2-yl) 3-(4-fluorophenyl)propanoate CAS Name: 3-(4-fluorophenyl)propanoic acid (5-methyl-3-oxo-1H-1,2,4-triazol-2-yl) ester IUPAC Name: (5-methyl-3-oxo-1H-1,2,4-triazol-2-yl) 3-(4-fluorophenyl)propanoate Traditional Name: 3-(4-fluorophenyl)propionic acid (3-keto-5-methyl-1H-1,2,4-triazol-2-yl) ester Formula: C12H12FN3O3 MolecularWeight: 265.240383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)N(N1)OC(=O)CCC2=CC=C(C=C2)F

Isomeric SMILES

CC1=NC(=O)N(N1)OC(=O)CCC2=CC=C(C=C2)F

InChI

InChI=1S/C12H12FN3O3/c1-8-14-12(18)16(15-8)19-11(17)7-4-9-2-5-10(13)6-3-9/h2-3,5-6H,4,7H2,1H3,(H,14,15,18)