[6,7-dimethoxy-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-yl]-(3,4-dimethylphenyl)methanone

Systemtic Name: [6,7-dimethoxy-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-yl]-(3,4-dimethylphenyl)methanone Openeye Name: [6,7-dimethoxy-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-yl]-(3,4-dimethylphenyl)methanone CAS Name: [6,7-dimethoxy-4-(4-methyl-1-piperazin-4-iumyl)-3-quinolin-1-iumyl]-(3,4-dimethylphenyl)methanone IUPAC Name: [6,7-dimethoxy-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-yl]-(3,4-dimethylphenyl)methanone Traditional Name: [6,7-dimethoxy-4-(4-methylpiperazin-4-ium-1-yl)quinolin-1-ium-3-yl]-(3,4-dimethylphenyl)methanone Formula: C25H31N3O3+2 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C2=C(C3=CC(=C(C=C3[NH+]=C2)OC)OC)N4CC[NH+](CC4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C2=C(C3=CC(=C(C=C3[NH+]=C2)OC)OC)N4CC[NH+](CC4)C)C

InChI

InChI=1S/C25H29N3O3/c1-16-6-7-18(12-17(16)2)25(29)20-15-26-21-14-23(31-5)22(30-4)13-19(21)24(20)28-10-8-27(3)9-11-28/h6-7,12-15H,8-11H2,1-5H3/p+2