N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-1H-indazole-3-carboxamide

Systemtic Name: N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-1H-indazole-3-carboxamide Openeye Name: N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-1H-indazole-3-carboxamide CAS Name: N-[(2S)-2-(4-fluorophenyl)-2-(4-morpholin-4-iumyl)ethyl]-1H-indazole-3-carboxamide IUPAC Name: N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-ylethyl]-1H-indazole-3-carboxamide Traditional Name: N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-1H-indazole-3-carboxamide Formula: C20H22FN4O2+ MolecularWeight: 369.412683

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=NNC3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

C1COCC[NH+]1[C@H](CNC(=O)C2=NNC3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H21FN4O2/c21-15-7-5-14(6-8-15)18(25-9-11-27-12-10-25)13-22-20(26)19-16-3-1-2-4-17(16)23-24-19/h1-8,18H,9-13H2,(H,22,26)(H,23,24)/p+1/t18-/m1/s1