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

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-5,6,7,8-tetrahydroisoquinolin-2-ium Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl]-5,6,7,8-tetrahydroisoquinolin-2-ium CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl]-5,6,7,8-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl]-5,6,7,8-tetrahydroisoquinolin-2-ium Traditional Name: 2-(2-chloro-6-fluoro-benzyl)-5,6,7,8-tetrahydroisoquinolin-2-ium Formula: C16H16ClFN+ MolecularWeight: 276.756343

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C[N+](=C2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CCC2=C(C1)C=C[N+](=C2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C16H16ClFN/c17-15-6-3-7-16(18)14(15)11-19-9-8-12-4-1-2-5-13(12)10-19/h3,6-10H,1-2,4-5,11H2/q+1