1-(4-fluorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: 1-(4-fluorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: 1-(4-fluorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: 1-(4-fluorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-9H-$b-carboline-3-carboxamide Formula: C25H26FN4O2+ MolecularWeight: 433.497943

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=NC(=C3C(=C2)C4=CC=CC=C4N3)C5=CC=C(C=C5)F

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=NC(=C3C(=C2)C4=CC=CC=C4N3)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H25FN4O2/c26-18-8-6-17(7-9-18)23-24-20(19-4-1-2-5-21(19)28-24)16-22(29-23)25(31)27-10-3-11-30-12-14-32-15-13-30/h1-2,4-9,16,28H,3,10-15H2,(H,27,31)/p+1