2-[(3-fluoranyl-4-methoxy-phenyl)methyl]-5,6,7,8-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methyl]-5,6,7,8-tetrahydroisoquinolin-2-ium Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methyl]-5,6,7,8-tetrahydroisoquinolin-2-ium CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methyl]-5,6,7,8-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methyl]-5,6,7,8-tetrahydroisoquinolin-2-ium Traditional Name: 2-(3-fluoro-4-methoxy-benzyl)-5,6,7,8-tetrahydroisoquinolin-2-ium Formula: C17H19FNO+ MolecularWeight: 272.337263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[N+]2=CC3=C(CCCC3)C=C2)F

Isomeric SMILES

COC1=C(C=C(C=C1)C[N+]2=CC3=C(CCCC3)C=C2)F

InChI

InChI=1S/C17H19FNO/c1-20-17-7-6-13(10-16(17)18)11-19-9-8-14-4-2-3-5-15(14)12-19/h6-10,12H,2-5,11H2,1H3/q+1