2-(2-fluoranylphenoxy)ethyl-[(2S)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: 2-(2-fluoranylphenoxy)ethyl-[(2S)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: 2-(2-fluorophenoxy)ethyl-[(1S)-2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: 2-(2-fluorophenoxy)ethyl-[(2S)-1-(1H-indol-3-yl)-1-oxopropan-2-yl]-methylammonium IUPAC Name: 2-(2-fluorophenoxy)ethyl-[(2S)-1-(1H-indol-3-yl)-1-oxopropan-2-yl]-methylazanium Traditional Name: 2-(2-fluorophenoxy)ethyl-[(1S)-2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C20H22FN2O2+ MolecularWeight: 341.399283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)[NH+](C)CCOC3=CC=CC=C3F

Isomeric SMILES

C[C@@H](C(=O)C1=CNC2=CC=CC=C21)[NH+](C)CCOC3=CC=CC=C3F

InChI

InChI=1S/C20H21FN2O2/c1-14(20(24)16-13-22-18-9-5-3-7-15(16)18)23(2)11-12-25-19-10-6-4-8-17(19)21/h3-10,13-14,22H,11-12H2,1-2H3/p+1/t14-/m0/s1