N-[cyclopropyl(phenyl)methyl]-3-[(1-oxidanidylpyrrolidin-1-ium-1-yl)methyl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[cyclopropyl(phenyl)methyl]-3-[(1-oxidanidylpyrrolidin-1-ium-1-yl)methyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[cyclopropyl(phenyl)methyl]-3-[(1-oxidopyrrolidin-1-ium-1-yl)methyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[cyclopropyl(phenyl)methyl]-3-[(1-oxido-1-pyrrolidin-1-iumyl)methyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[cyclopropyl(phenyl)methyl]-3-[(1-oxidopyrrolidin-1-ium-1-yl)methyl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[cyclopropyl(phenyl)methyl]-3-[(1-oxidopyrrolidin-1-ium-1-yl)methyl]-2-phenyl-cinchoninamide Formula: C31H31N3O2 MolecularWeight: 477.59674

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C1)(CC2=C(C3=CC=CC=C3N=C2C4=CC=CC=C4)C(=O)NC(C5CC5)C6=CC=CC=C6)[O-]

Isomeric SMILES

C1CC[N+](C1)(CC2=C(C3=CC=CC=C3N=C2C4=CC=CC=C4)C(=O)NC(C5CC5)C6=CC=CC=C6)[O-]

InChI

InChI=1S/C31H31N3O2/c35-31(33-29(24-17-18-24)22-11-3-1-4-12-22)28-25-15-7-8-16-27(25)32-30(23-13-5-2-6-14-23)26(28)21-34(36)19-9-10-20-34/h1-8,11-16,24,29H,9-10,17-21H2,(H,33,35)