2-(4-methoxyphenyl)-6-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-methoxyphenyl)-6-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]quinoline-4-carboxamide Openeye Name: 2-(4-methoxyphenyl)-6-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]quinoline-4-carboxamide CAS Name: 2-(4-methoxyphenyl)-6-methyl-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-methoxyphenyl)-6-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]quinoline-4-carboxamide Traditional Name: 2-(4-methoxyphenyl)-6-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]cinchoninamide Formula: C27H34N3O2+ MolecularWeight: 432.57776

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C2=CC(=NC3=C2C=C(C=C3)C)C4=CC=C(C=C4)OC

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)C2=CC(=NC3=C2C=C(C=C3)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H33N3O2/c1-19-8-13-25-23(17-19)24(18-26(29-25)21-9-11-22(32-3)12-10-21)27(31)28-14-6-16-30-15-5-4-7-20(30)2/h8-13,17-18,20H,4-7,14-16H2,1-3H3,(H,28,31)/p+1/t20-/m0/s1