3-[1,1-bis(fluoranyl)butyl]-5-butyl-1H-1,2,4-triazole

Systemtic Name: 3-[1,1-bis(fluoranyl)butyl]-5-butyl-1H-1,2,4-triazole Openeye Name: 5-butyl-3-(1,1-difluorobutyl)-1H-1,2,4-triazole CAS Name: 5-butyl-3-(1,1-difluorobutyl)-1H-1,2,4-triazole IUPAC Name: 5-butyl-3-(1,1-difluorobutyl)-1H-1,2,4-triazole Traditional Name: 5-butyl-3-(1,1-difluorobutyl)-1H-1,2,4-triazole Formula: C10H17F2N3 MolecularWeight: 217.258886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NN1)C(CCC)(F)F

Isomeric SMILES

CCCCC1=NC(=NN1)C(CCC)(F)F

InChI

InChI=1S/C10H17F2N3/c1-3-5-6-8-13-9(15-14-8)10(11,12)7-4-2/h3-7H2,1-2H3,(H,13,14,15)