N-[[2-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]naphthalen-1-yl]methyl]pyridin-1-ium-2-amine

Systemtic Name: N-[[2-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]naphthalen-1-yl]methyl]pyridin-1-ium-2-amine Openeye Name: N-[[2-[(2-chloro-6-fluoro-phenyl)methoxy]-1-naphthyl]methyl]pyridin-1-ium-2-amine CAS Name: N-[[2-[(2-chloro-6-fluorophenyl)methoxy]-1-naphthalenyl]methyl]-2-pyridin-1-iumamine IUPAC Name: N-[[2-[(2-chloro-6-fluorophenyl)methoxy]naphthalen-1-yl]methyl]pyridin-1-ium-2-amine Traditional Name: [2-(2-chloro-6-fluoro-benzyl)oxy-1-naphthyl]methyl-pyridin-1-ium-2-yl-amine Formula: C23H19ClFN2O+ MolecularWeight: 393.861163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2CNC3=CC=CC=[NH+]3)OCC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2CNC3=CC=CC=[NH+]3)OCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C23H18ClFN2O/c24-20-8-5-9-21(25)19(20)15-28-22-12-11-16-6-1-2-7-17(16)18(22)14-27-23-10-3-4-13-26-23/h1-13H,14-15H2,(H,26,27)/p+1