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

Systemtic Name: 7-chloranyl-8-methyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-7-chloro-8-methyl-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: 7-chloro-8-methyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-7-chloro-8-methyl-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-7-chloro-8-methyl-2-(2-pyridyl)cinchoninamide Formula: C28H28ClN4O+ MolecularWeight: 472.00112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)C5=CC=CC=N5)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)C5=CC=CC=N5)Cl

InChI

InChI=1S/C28H27ClN4O/c1-19-24(29)11-10-22-23(17-26(32-27(19)22)25-9-5-6-14-30-25)28(34)31-21-12-15-33(16-13-21)18-20-7-3-2-4-8-20/h2-11,14,17,21H,12-13,15-16,18H2,1H3,(H,31,34)/p+1