2-[4-(4-fluorophenyl)piperazin-1-yl]-6-methoxy-4-methyl-quinolin-1-ium

Systemtic Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-methoxy-4-methyl-quinolin-1-ium Openeye Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-methoxy-4-methyl-quinolin-1-ium CAS Name: 2-[4-(4-fluorophenyl)-1-piperazinyl]-6-methoxy-4-methylquinolin-1-ium IUPAC Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-6-methoxy-4-methylquinolin-1-ium Traditional Name: 2-[4-(4-fluorophenyl)piperazino]-6-methoxy-4-methyl-quinolin-1-ium Formula: C21H23FN3O+ MolecularWeight: 352.425223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C1C=C(C=C2)OC)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=[NH+]C2=C1C=C(C=C2)OC)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3O/c1-15-13-21(23-20-8-7-18(26-2)14-19(15)20)25-11-9-24(10-12-25)17-5-3-16(22)4-6-17/h3-8,13-14H,9-12H2,1-2H3/p+1