4-[bis(fluoranyl)methyl]-2,5-dimethyl-1,2,4-triazol-3-one

Systemtic Name: 4-[bis(fluoranyl)methyl]-2,5-dimethyl-1,2,4-triazol-3-one Openeye Name: 4-(difluoromethyl)-2,5-dimethyl-1,2,4-triazol-3-one CAS Name: 4-(difluoromethyl)-2,5-dimethyl-1,2,4-triazol-3-one IUPAC Name: 4-(difluoromethyl)-2,5-dimethyl-1,2,4-triazol-3-one Traditional Name: 4-(difluoromethyl)-2,5-dimethyl-1,2,4-triazol-3-one Formula: C5H7F2N3O MolecularWeight: 163.125386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1C(F)F)C

Isomeric SMILES

CC1=NN(C(=O)N1C(F)F)C

InChI

InChI=1S/C5H7F2N3O/c1-3-8-9(2)5(11)10(3)4(6)7/h4H,1-2H3