2-(3,4-dimethoxyphenyl)-N-(4-methylpiperazin-4-ium-1-yl)quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-(4-methylpiperazin-4-ium-1-yl)quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-(4-methylpiperazin-4-ium-1-yl)quinoline-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-(4-methyl-1-piperazin-4-iumyl)-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-(4-methylpiperazin-4-ium-1-yl)quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-(4-methylpiperazin-4-ium-1-yl)cinchoninamide Formula: C23H27N4O3+ MolecularWeight: 407.48548

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C23H26N4O3/c1-26-10-12-27(13-11-26)25-23(28)18-15-20(24-19-7-5-4-6-17(18)19)16-8-9-21(29-2)22(14-16)30-3/h4-9,14-15H,10-13H2,1-3H3,(H,25,28)/p+1