N,3,6-trimethyl-2-(1H-pyrazol-4-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)quinoline-4-carboxamide

Systemtic Name: N,3,6-trimethyl-2-(1H-pyrazol-4-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)quinoline-4-carboxamide Openeye Name: N,3,6-trimethyl-2-(1H-pyrazol-4-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)quinoline-4-carboxamide CAS Name: N,3,6-trimethyl-2-(1H-pyrazol-4-yl)-N-[3-(1-pyrrolidin-1-iumyl)propyl]-4-quinolinecarboxamide IUPAC Name: N,3,6-trimethyl-2-(1H-pyrazol-4-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)quinoline-4-carboxamide Traditional Name: N,3,6-trimethyl-2-(1H-pyrazol-4-yl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)cinchoninamide Formula: C23H30N5O+ MolecularWeight: 392.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(N=C2C=C1)C3=CNN=C3)C)C(=O)N(C)CCC[NH+]4CCCC4

Isomeric SMILES

CC1=CC2=C(C(=C(N=C2C=C1)C3=CNN=C3)C)C(=O)N(C)CCC[NH+]4CCCC4

InChI

InChI=1S/C23H29N5O/c1-16-7-8-20-19(13-16)21(17(2)22(26-20)18-14-24-25-15-18)23(29)27(3)9-6-12-28-10-4-5-11-28/h7-8,13-15H,4-6,9-12H2,1-3H3,(H,24,25)/p+1