(2S)-2-[2,2-bis(fluoranyl)hept-6-enylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[2,2-bis(fluoranyl)hept-6-enylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-(2,2-difluorohept-6-enylamino)-3-methyl-butanoic acid CAS Name: (2S)-2-(2,2-difluorohept-6-enylamino)-3-methylbutanoic acid IUPAC Name: (2S)-2-(2,2-difluorohept-6-enylamino)-3-methylbutanoic acid Traditional Name: (2S)-2-(2,2-difluorohept-6-enylamino)-3-methyl-butyric acid Formula: C12H21F2NO2 MolecularWeight: 249.297446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC(CCCC=C)(F)F

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NCC(CCCC=C)(F)F

InChI

InChI=1S/C12H21F2NO2/c1-4-5-6-7-12(13,14)8-15-10(9(2)3)11(16)17/h4,9-10,15H,1,5-8H2,2-3H3,(H,16,17)/t10-/m0/s1