2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]quinoline-4-carboxamide Openeye Name: 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]quinoline-4-carboxamide CAS Name: 2-(4-fluorophenyl)-N-[(2R)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]quinoline-4-carboxamide Traditional Name: 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]cinchoninamide Formula: C26H25FN3O2S+ MolecularWeight: 462.559003

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F)C5=CC=CS5

Isomeric SMILES

C1COCC[NH+]1[C@H](CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F)C5=CC=CS5

InChI

InChI=1S/C26H24FN3O2S/c27-19-9-7-18(8-10-19)23-16-21(20-4-1-2-5-22(20)29-23)26(31)28-17-24(25-6-3-15-33-25)30-11-13-32-14-12-30/h1-10,15-16,24H,11-14,17H2,(H,28,31)/p+1/t24-/m1/s1