[4-fluoranyl-3-(3-pyridin-4-ylpropoxymethyl)phenyl]methylazanium

Systemtic Name: [4-fluoranyl-3-(3-pyridin-4-ylpropoxymethyl)phenyl]methylazanium Openeye Name: [4-fluoro-3-[3-(4-pyridyl)propoxymethyl]phenyl]methylammonium CAS Name: [4-fluoro-3-(3-pyridin-4-ylpropoxymethyl)phenyl]methylammonium IUPAC Name: [4-fluoro-3-(3-pyridin-4-ylpropoxymethyl)phenyl]methylazanium Traditional Name: [4-fluoro-3-[3-(4-pyridyl)propoxymethyl]benzyl]ammonium Formula: C16H20FN2O+ MolecularWeight: 275.341203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C[NH3+])COCCCC2=CC=NC=C2)F

Isomeric SMILES

C1=CC(=C(C=C1C[NH3+])COCCCC2=CC=NC=C2)F

InChI

InChI=1S/C16H19FN2O/c17-16-4-3-14(11-18)10-15(16)12-20-9-1-2-13-5-7-19-8-6-13/h3-8,10H,1-2,9,11-12,18H2/p+1