2-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]quinoline-4-carboxamide

Systemtic Name: 2-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]quinoline-4-carboxamide Openeye Name: 2-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]quinoline-4-carboxamide CAS Name: 2-methyl-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-4-quinolinecarboxamide IUPAC Name: 2-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]quinoline-4-carboxamide Traditional Name: 2-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]cinchoninamide Formula: C20H28N3O+ MolecularWeight: 326.45582

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C2=CC(=NC3=CC=CC=C32)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)C2=CC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C20H27N3O/c1-15-14-18(17-9-3-4-10-19(17)22-15)20(24)21-11-7-13-23-12-6-5-8-16(23)2/h3-4,9-10,14,16H,5-8,11-13H2,1-2H3,(H,21,24)/p+1/t16-/m0/s1