5,8-dimethoxy-4-methyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinolin-1-ium

Systemtic Name: 5,8-dimethoxy-4-methyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinolin-1-ium Openeye Name: 5,8-dimethoxy-4-methyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinolin-1-ium CAS Name: 5,8-dimethoxy-4-methyl-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]quinolin-1-ium IUPAC Name: 5,8-dimethoxy-4-methyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)quinolin-1-ium Traditional Name: 5,8-dimethoxy-4-methyl-2-(4-pyridin-1-ium-2-ylpiperazino)quinolin-1-ium Formula: C21H26N4O2+2 MolecularWeight: 366.45674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C2=C(C=CC(=C12)OC)OC)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CC1=CC(=[NH+]C2=C(C=CC(=C12)OC)OC)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C21H24N4O2/c1-15-14-19(23-21-17(27-3)8-7-16(26-2)20(15)21)25-12-10-24(11-13-25)18-6-4-5-9-22-18/h4-9,14H,10-13H2,1-3H3/p+2