2-cyclopropyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]quinoline-4-carboxamide

Systemtic Name: 2-cyclopropyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]quinoline-4-carboxamide Openeye Name: 2-cyclopropyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]quinoline-4-carboxamide CAS Name: 2-cyclopropyl-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-cyclopropyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]quinoline-4-carboxamide Traditional Name: 2-cyclopropyl-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]cinchoninamide Formula: C25H28N3O2+ MolecularWeight: 402.50872

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC=C4C[NH+]5CCOCC5

Isomeric SMILES

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC=C4C[NH+]5CCOCC5

InChI

InChI=1S/C25H27N3O2/c29-25(22-15-24(18-9-10-18)27-23-8-4-3-7-21(22)23)26-16-19-5-1-2-6-20(19)17-28-11-13-30-14-12-28/h1-8,15,18H,9-14,16-17H2,(H,26,29)/p+1