N-(2-morpholin-4-ium-4-ylethyl)-2-(4-phenylphenyl)quinoline-4-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(4-phenylphenyl)quinoline-4-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(4-phenylphenyl)quinoline-4-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-2-(4-phenylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(4-phenylphenyl)quinoline-4-carboxamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(4-phenylphenyl)cinchoninamide Formula: C28H28N3O2+ MolecularWeight: 438.54082

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H27N3O2/c32-28(29-14-15-31-16-18-33-19-17-31)25-20-27(30-26-9-5-4-8-24(25)26)23-12-10-22(11-13-23)21-6-2-1-3-7-21/h1-13,20H,14-19H2,(H,29,32)/p+1