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

Systemtic Name: 7-chloranyl-8-methyl-N-(2-piperidin-1-ium-1-ylethyl)-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: 7-chloro-8-methyl-N-(2-piperidin-1-ium-1-ylethyl)-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: 7-chloro-8-methyl-N-[2-(1-piperidin-1-iumyl)ethyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: 7-chloro-8-methyl-N-(2-piperidin-1-ium-1-ylethyl)-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: 7-chloro-8-methyl-N-(2-piperidin-1-ium-1-ylethyl)-2-(4-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=NC=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C23H25ClN4O/c1-16-20(24)6-5-18-19(23(29)26-11-14-28-12-3-2-4-13-28)15-21(27-22(16)18)17-7-9-25-10-8-17/h5-10,15H,2-4,11-14H2,1H3,(H,26,29)/p+1