2-adamantyl-[[2-[(2-fluorophenyl)methoxy]naphthalen-1-yl]methyl]azanium

Systemtic Name: 2-adamantyl-[[2-[(2-fluorophenyl)methoxy]naphthalen-1-yl]methyl]azanium Openeye Name: 2-adamantyl-[[2-[(2-fluorophenyl)methoxy]-1-naphthyl]methyl]ammonium CAS Name: 2-adamantyl-[[2-[(2-fluorophenyl)methoxy]-1-naphthalenyl]methyl]ammonium IUPAC Name: 2-adamantyl-[[2-[(2-fluorophenyl)methoxy]naphthalen-1-yl]methyl]azanium Traditional Name: 2-adamantyl-[[2-(2-fluorobenzyl)oxy-1-naphthyl]methyl]ammonium Formula: C28H31FNO+ MolecularWeight: 416.550243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3[NH2+]CC4=C(C=CC5=CC=CC=C54)OCC6=CC=CC=C6F

Isomeric SMILES

C1C2CC3CC1CC(C2)C3[NH2+]CC4=C(C=CC5=CC=CC=C54)OCC6=CC=CC=C6F

InChI

InChI=1S/C28H30FNO/c29-26-8-4-2-6-21(26)17-31-27-10-9-20-5-1-3-7-24(20)25(27)16-30-28-22-12-18-11-19(14-22)15-23(28)13-18/h1-10,18-19,22-23,28,30H,11-17H2/p+1