(2R)-2-(5-fluoranyl-2-methoxy-phenyl)azepan-1-ium

Systemtic Name: (2R)-2-(5-fluoranyl-2-methoxy-phenyl)azepan-1-ium Openeye Name: (2R)-2-(5-fluoro-2-methoxy-phenyl)azepan-1-ium CAS Name: (2R)-2-(5-fluoro-2-methoxyphenyl)azepan-1-ium IUPAC Name: (2R)-2-(5-fluoro-2-methoxyphenyl)azepan-1-ium Traditional Name: (2R)-2-(5-fluoro-2-methoxy-phenyl)azepan-1-ium Formula: C13H19FNO+ MolecularWeight: 224.294463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C2CCCCC[NH2+]2

Isomeric SMILES

COC1=C(C=C(C=C1)F)[C@H]2CCCCC[NH2+]2

InChI

InChI=1S/C13H18FNO/c1-16-13-7-6-10(14)9-11(13)12-5-3-2-4-8-15-12/h6-7,9,12,15H,2-5,8H2,1H3/p+1/t12-/m1/s1