[(2S)-4-(4-fluoranyl-3-methyl-phenyl)butan-2-yl]azanium

Systemtic Name: [(2S)-4-(4-fluoranyl-3-methyl-phenyl)butan-2-yl]azanium Openeye Name: [(1S)-3-(4-fluoro-3-methyl-phenyl)-1-methyl-propyl]ammonium CAS Name: [(2S)-4-(4-fluoro-3-methylphenyl)butan-2-yl]ammonium IUPAC Name: [(2S)-4-(4-fluoro-3-methylphenyl)butan-2-yl]azanium Traditional Name: [(1S)-3-(4-fluoro-3-methyl-phenyl)-1-methyl-propyl]ammonium Formula: C11H17FN+ MolecularWeight: 182.257783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCC(C)[NH3+])F

Isomeric SMILES

CC1=C(C=CC(=C1)CC[C@H](C)[NH3+])F

InChI

InChI=1S/C11H16FN/c1-8-7-10(4-3-9(2)13)5-6-11(8)12/h5-7,9H,3-4,13H2,1-2H3/p+1/t9-/m0/s1