2-phenyl-N-[(2R)-1-piperidin-1-ium-1-ylpropan-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-phenyl-N-[(2R)-1-piperidin-1-ium-1-ylpropan-2-yl]quinoline-4-carboxamide Openeye Name: N-[(1R)-1-methyl-2-piperidin-1-ium-1-yl-ethyl]-2-phenyl-quinoline-4-carboxamide CAS Name: 2-phenyl-N-[(2R)-1-(1-piperidin-1-iumyl)propan-2-yl]-4-quinolinecarboxamide IUPAC Name: 2-phenyl-N-[(2R)-1-piperidin-1-ium-1-ylpropan-2-yl]quinoline-4-carboxamide Traditional Name: N-[(1R)-1-methyl-2-piperidin-1-ium-1-yl-ethyl]-2-phenyl-cinchoninamide Formula: C24H28N3O+ MolecularWeight: 374.49862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCCCC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C[NH+]1CCCCC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O/c1-18(17-27-14-8-3-9-15-27)25-24(28)21-16-23(19-10-4-2-5-11-19)26-22-13-7-6-12-20(21)22/h2,4-7,10-13,16,18H,3,8-9,14-15,17H2,1H3,(H,25,28)/p+1/t18-/m1/s1