2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-fluoranyl-4-methyl-quinolin-1-ium

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-fluoranyl-4-methyl-quinolin-1-ium Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-fluoro-4-methyl-quinolin-1-ium CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-fluoro-4-methylquinolin-1-ium IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-fluoro-4-methylquinolin-1-ium Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-7-fluoro-4-methyl-quinolin-1-ium Formula: C19H18FN2+ MolecularWeight: 293.358023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C1C=CC(=C2)F)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=[NH+]C2=C1C=CC(=C2)F)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C19H17FN2/c1-13-10-19(21-18-11-16(20)6-7-17(13)18)22-9-8-14-4-2-3-5-15(14)12-22/h2-7,10-11H,8-9,12H2,1H3/p+1