2-[4-(4-fluorophenyl)piperazin-1-yl]-6,8-dimethoxy-4-methyl-quinolin-1-ium

Systemtic Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-6,8-dimethoxy-4-methyl-quinolin-1-ium Openeye Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-6,8-dimethoxy-4-methyl-quinolin-1-ium CAS Name: 2-[4-(4-fluorophenyl)-1-piperazinyl]-6,8-dimethoxy-4-methylquinolin-1-ium IUPAC Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-6,8-dimethoxy-4-methylquinolin-1-ium Traditional Name: 2-[4-(4-fluorophenyl)piperazino]-6,8-dimethoxy-4-methyl-quinolin-1-ium Formula: C22H25FN3O2+ MolecularWeight: 382.451203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C(C=C(C=C12)OC)OC)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=[NH+]C2=C(C=C(C=C12)OC)OC)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H24FN3O2/c1-15-12-21(24-22-19(15)13-18(27-2)14-20(22)28-3)26-10-8-25(9-11-26)17-6-4-16(23)5-7-17/h4-7,12-14H,8-11H2,1-3H3/p+1