[3,4-bis(fluoranyl)phenyl]methyl-[(2S)-6-methylheptan-2-yl]azanium

Systemtic Name: [3,4-bis(fluoranyl)phenyl]methyl-[(2S)-6-methylheptan-2-yl]azanium Openeye Name: (3,4-difluorophenyl)methyl-[(1S)-1,5-dimethylhexyl]ammonium CAS Name: (3,4-difluorophenyl)methyl-[(2S)-6-methylheptan-2-yl]ammonium IUPAC Name: (3,4-difluorophenyl)methyl-[(2S)-6-methylheptan-2-yl]azanium Traditional Name: (3,4-difluorobenzyl)-[(1S)-1,5-dimethylhexyl]ammonium Formula: C15H24F2N+ MolecularWeight: 256.354566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)[NH2+]CC1=CC(=C(C=C1)F)F

Isomeric SMILES

C[C@@H](CCCC(C)C)[NH2+]CC1=CC(=C(C=C1)F)F

InChI

InChI=1S/C15H23F2N/c1-11(2)5-4-6-12(3)18-10-13-7-8-14(16)15(17)9-13/h7-9,11-12,18H,4-6,10H2,1-3H3/p+1/t12-/m0/s1