N-(2-cyano-1-phenyl-ethyl)-3-[(4-oxidanidylmorpholin-4-ium-4-yl)methyl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-(2-cyano-1-phenyl-ethyl)-3-[(4-oxidanidylmorpholin-4-ium-4-yl)methyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-(2-cyano-1-phenyl-ethyl)-3-[(4-oxidomorpholin-4-ium-4-yl)methyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-(2-cyano-1-phenylethyl)-3-[(4-oxido-4-morpholin-4-iumyl)methyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-(2-cyano-1-phenylethyl)-3-[(4-oxidomorpholin-4-ium-4-yl)methyl]-2-phenylquinoline-4-carboxamide Traditional Name: N-(2-cyano-1-phenyl-ethyl)-3-[(4-oxidomorpholin-4-ium-4-yl)methyl]-2-phenyl-cinchoninamide Formula: C30H28N4O3 MolecularWeight: 492.56832

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[N+]1(CC2=C(C3=CC=CC=C3N=C2C4=CC=CC=C4)C(=O)NC(CC#N)C5=CC=CC=C5)[O-]

Isomeric SMILES

C1COCC[N+]1(CC2=C(C3=CC=CC=C3N=C2C4=CC=CC=C4)C(=O)NC(CC#N)C5=CC=CC=C5)[O-]

InChI

InChI=1S/C30H28N4O3/c31-16-15-26(22-9-3-1-4-10-22)33-30(35)28-24-13-7-8-14-27(24)32-29(23-11-5-2-6-12-23)25(28)21-34(36)17-19-37-20-18-34/h1-14,26H,15,17-21H2,(H,33,35)