(2-chloranyl-6-fluoranyl-phenyl)methyl-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (2-chloro-6-fluoro-phenyl)methyl-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-methyl-ammonium CAS Name: (2-chloro-6-fluorophenyl)methyl-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-methylammonium IUPAC Name: (2-chloro-6-fluorophenyl)methyl-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-methylazanium Traditional Name: (2-chloro-6-fluoro-benzyl)-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-methyl-ammonium Formula: C19H21ClFN2O+ MolecularWeight: 347.834243

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=CC=C1Cl)F)CC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

C[NH+](CC1=C(C=CC=C1Cl)F)CC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C19H20ClFN2O/c1-22(12-16-17(20)7-4-8-18(16)21)13-19(24)23-10-9-14-5-2-3-6-15(14)11-23/h2-8H,9-13H2,1H3/p+1