2-methyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]quinoline-4-carboxamide

Systemtic Name: 2-methyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]quinoline-4-carboxamide Openeye Name: 2-methyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]quinoline-4-carboxamide CAS Name: 2-methyl-N-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]-4-quinolinecarboxamide IUPAC Name: 2-methyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]quinoline-4-carboxamide Traditional Name: 2-methyl-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]cinchoninamide Formula: C23H26N3O+ MolecularWeight: 360.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)NCC(C3=CC=CC=C3)[NH+]4CCCC4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)NC[C@@H](C3=CC=CC=C3)[NH+]4CCCC4

InChI

InChI=1S/C23H25N3O/c1-17-15-20(19-11-5-6-12-21(19)25-17)23(27)24-16-22(26-13-7-8-14-26)18-9-3-2-4-10-18/h2-6,9-12,15,22H,7-8,13-14,16H2,1H3,(H,24,27)/p+1/t22-/m0/s1