[3,4-bis(fluoranyl)phenyl]methyl-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: [3,4-bis(fluoranyl)phenyl]methyl-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: (3,4-difluorophenyl)methyl-[(1S)-1,4-dimethylpentyl]ammonium CAS Name: (3,4-difluorophenyl)methyl-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: (3,4-difluorophenyl)methyl-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: (3,4-difluorobenzyl)-[(1S)-1,4-dimethylpentyl]ammonium Formula: C14H22F2N+ MolecularWeight: 242.327986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21F2N/c1-10(2)4-5-11(3)17-9-12-6-7-13(15)14(16)8-12/h6-8,10-11,17H,4-5,9H2,1-3H3/p+1/t11-/m0/s1