7-chloranyl-8-methyl-N-(2-piperidin-1-ium-1-ylethyl)-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: 7-chloranyl-8-methyl-N-(2-piperidin-1-ium-1-ylethyl)-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: 7-chloro-8-methyl-N-(2-piperidin-1-ium-1-ylethyl)-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: 7-chloro-8-methyl-N-[2-(1-piperidin-1-iumyl)ethyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 7-chloro-8-methyl-N-(2-piperidin-1-ium-1-ylethyl)-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: 7-chloro-8-methyl-N-(2-piperidin-1-ium-1-ylethyl)-2-(2-pyridyl)cinchoninamide Formula: C23H26ClN4O+ MolecularWeight: 409.93174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)NCC[NH+]3CCCCC3)C4=CC=CC=N4)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)NCC[NH+]3CCCCC3)C4=CC=CC=N4)Cl

InChI

InChI=1S/C23H25ClN4O/c1-16-19(24)9-8-17-18(23(29)26-11-14-28-12-5-2-6-13-28)15-21(27-22(16)17)20-7-3-4-10-25-20/h3-4,7-10,15H,2,5-6,11-14H2,1H3,(H,26,29)/p+1