1-(4-fluorophenyl)-7,8-dimethoxy-3-methyl-isoquinolin-2-ium-2-amine

Systemtic Name: 1-(4-fluorophenyl)-7,8-dimethoxy-3-methyl-isoquinolin-2-ium-2-amine Openeye Name: 1-(4-fluorophenyl)-7,8-dimethoxy-3-methyl-isoquinolin-2-ium-2-amine CAS Name: 1-(4-fluorophenyl)-7,8-dimethoxy-3-methyl-2-isoquinolin-2-iumamine IUPAC Name: 1-(4-fluorophenyl)-7,8-dimethoxy-3-methylisoquinolin-2-ium-2-amine Traditional Name: [1-(4-fluorophenyl)-7,8-dimethoxy-3-methyl-isoquinolin-2-ium-2-yl]amine Formula: C18H18FN2O2+ MolecularWeight: 313.346123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=C2C(=C1)C=CC(=C2OC)OC)C3=CC=C(C=C3)F)N

Isomeric SMILES

CC1=[N+](C(=C2C(=C1)C=CC(=C2OC)OC)C3=CC=C(C=C3)F)N

InChI

InChI=1S/C18H18FN2O2/c1-11-10-13-6-9-15(22-2)18(23-3)16(13)17(21(11)20)12-4-7-14(19)8-5-12/h4-10H,20H2,1-3H3/q+1