[6,7-dimethoxy-4-[4-(2-methoxyphenyl)piperazin-1-yl]quinolin-1-ium-3-yl]-phenyl-methanone

Systemtic Name: [6,7-dimethoxy-4-[4-(2-methoxyphenyl)piperazin-1-yl]quinolin-1-ium-3-yl]-phenyl-methanone Openeye Name: [6,7-dimethoxy-4-[4-(2-methoxyphenyl)piperazin-1-yl]quinolin-1-ium-3-yl]-phenyl-methanone CAS Name: [6,7-dimethoxy-4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-quinolin-1-iumyl]-phenylmethanone IUPAC Name: [6,7-dimethoxy-4-[4-(2-methoxyphenyl)piperazin-1-yl]quinolin-1-ium-3-yl]-phenylmethanone Traditional Name: [6,7-dimethoxy-4-[4-(2-methoxyphenyl)piperazino]quinolin-1-ium-3-yl]-phenyl-methanone Formula: C29H30N3O4+ MolecularWeight: 484.5662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=[NH+]C4=CC(=C(C=C43)OC)OC)C(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=[NH+]C4=CC(=C(C=C43)OC)OC)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H29N3O4/c1-34-25-12-8-7-11-24(25)31-13-15-32(16-14-31)28-21-17-26(35-2)27(36-3)18-23(21)30-19-22(28)29(33)20-9-5-4-6-10-20/h4-12,17-19H,13-16H2,1-3H3/p+1