2-cyclopropyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]quinoline-4-carboxamide

Systemtic Name: 2-cyclopropyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]quinoline-4-carboxamide Openeye Name: 2-cyclopropyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]quinoline-4-carboxamide CAS Name: 2-cyclopropyl-N-[4-(4-ethyl-1-piperazin-4-iumyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-cyclopropyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]quinoline-4-carboxamide Traditional Name: 2-cyclopropyl-N-[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]cinchoninamide Formula: C25H29N4O+ MolecularWeight: 401.52396

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C25H28N4O/c1-2-28-13-15-29(16-14-28)20-11-9-19(10-12-20)26-25(30)22-17-24(18-7-8-18)27-23-6-4-3-5-21(22)23/h3-6,9-12,17-18H,2,7-8,13-16H2,1H3,(H,26,30)/p+1