[(2S)-butan-2-yl]-[2-(4-fluoranylphenoxy)ethyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[2-(4-fluoranylphenoxy)ethyl]azanium Openeye Name: 2-(4-fluorophenoxy)ethyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[2-(4-fluorophenoxy)ethyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[2-(4-fluorophenoxy)ethyl]azanium Traditional Name: 2-(4-fluorophenoxy)ethyl-[(1S)-1-methylpropyl]ammonium Formula: C12H19FNO+ MolecularWeight: 212.283763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCOC1=CC=C(C=C1)F

Isomeric SMILES

CC[C@H](C)[NH2+]CCOC1=CC=C(C=C1)F

InChI

InChI=1S/C12H18FNO/c1-3-10(2)14-8-9-15-12-6-4-11(13)5-7-12/h4-7,10,14H,3,8-9H2,1-2H3/p+1/t10-/m0/s1