2-[3-(3,4-dimethoxyphenyl)-4-fluoranyl-phenyl]ethylazanium

Systemtic Name: 2-[3-(3,4-dimethoxyphenyl)-4-fluoranyl-phenyl]ethylazanium Openeye Name: 2-[3-(3,4-dimethoxyphenyl)-4-fluoro-phenyl]ethylammonium CAS Name: 2-[3-(3,4-dimethoxyphenyl)-4-fluorophenyl]ethylammonium IUPAC Name: 2-[3-(3,4-dimethoxyphenyl)-4-fluorophenyl]ethylazanium Traditional Name: 2-[3-(3,4-dimethoxyphenyl)-4-fluoro-phenyl]ethylammonium Formula: C16H19FNO2+ MolecularWeight: 276.325963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C=CC(=C2)CC[NH3+])F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C=CC(=C2)CC[NH3+])F)OC

InChI

InChI=1S/C16H18FNO2/c1-19-15-6-4-12(10-16(15)20-2)13-9-11(7-8-18)3-5-14(13)17/h3-6,9-10H,7-8,18H2,1-2H3/p+1