[(1S)-2-azanyl-1-(4-fluorophenyl)-2-oxidanylidene-ethyl]-methyl-(3-phenoxypropyl)azanium

Systemtic Name: [(1S)-2-azanyl-1-(4-fluorophenyl)-2-oxidanylidene-ethyl]-methyl-(3-phenoxypropyl)azanium Openeye Name: [(1S)-2-amino-1-(4-fluorophenyl)-2-oxo-ethyl]-methyl-(3-phenoxypropyl)ammonium CAS Name: [(1S)-2-amino-1-(4-fluorophenyl)-2-oxoethyl]-methyl-(3-phenoxypropyl)ammonium IUPAC Name: [(1S)-2-amino-1-(4-fluorophenyl)-2-oxoethyl]-methyl-(3-phenoxypropyl)azanium Traditional Name: [(1S)-2-amino-1-(4-fluorophenyl)-2-keto-ethyl]-methyl-(3-phenoxypropyl)ammonium Formula: C18H22FN2O2+ MolecularWeight: 317.377883

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCOC1=CC=CC=C1)C(C2=CC=C(C=C2)F)C(=O)N

Isomeric SMILES

C[NH+](CCCOC1=CC=CC=C1)[C@@H](C2=CC=C(C=C2)F)C(=O)N

InChI

InChI=1S/C18H21FN2O2/c1-21(12-5-13-23-16-6-3-2-4-7-16)17(18(20)22)14-8-10-15(19)11-9-14/h2-4,6-11,17H,5,12-13H2,1H3,(H2,20,22)/p+1/t17-/m0/s1