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

Systemtic Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-(1-cyclopropyl-4-piperidin-1-iumyl)-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-2-(3-pyridyl)cinchoninamide Formula: C23H25N4O+ MolecularWeight: 373.4708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+]2CCC(CC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1CC1[NH+]2CCC(CC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C23H24N4O/c28-23(25-17-9-12-27(13-10-17)18-7-8-18)20-14-22(16-4-3-11-24-15-16)26-21-6-2-1-5-19(20)21/h1-6,11,14-15,17-18H,7-10,12-13H2,(H,25,28)/p+1