N-(3-piperidin-1-ium-1-ylpropyl)-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-(3-piperidin-1-ium-1-ylpropyl)-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-(3-piperidin-1-ium-1-ylpropyl)-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[3-(1-piperidin-1-iumyl)propyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(3-piperidin-1-ium-1-ylpropyl)-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(3-piperidin-1-ium-1-ylpropyl)-2-(3-pyridyl)cinchoninamide Formula: C23H27N4O+ MolecularWeight: 375.48668

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4

InChI

InChI=1S/C23H26N4O/c28-23(25-12-7-15-27-13-4-1-5-14-27)20-16-22(18-8-6-11-24-17-18)26-21-10-3-2-9-19(20)21/h2-3,6,8-11,16-17H,1,4-5,7,12-15H2,(H,25,28)/p+1