(3-fluorophenyl)methyl-[(2S)-1-(3-methoxypropylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (3-fluorophenyl)methyl-[(2S)-1-(3-methoxypropylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (3-fluorophenyl)methyl-[(1S)-2-(3-methoxypropylamino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: (3-fluorophenyl)methyl-[(2S)-1-(3-methoxypropylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: (3-fluorophenyl)methyl-[(2S)-1-(3-methoxypropylamino)-1-oxopropan-2-yl]azanium Traditional Name: (3-fluorobenzyl)-[(1S)-2-keto-2-(3-methoxypropylamino)-1-methyl-ethyl]ammonium Formula: C14H22FN2O2+ MolecularWeight: 269.335083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCOC)[NH2+]CC1=CC(=CC=C1)F

Isomeric SMILES

C[C@@H](C(=O)NCCCOC)[NH2+]CC1=CC(=CC=C1)F

InChI

InChI=1S/C14H21FN2O2/c1-11(14(18)16-7-4-8-19-2)17-10-12-5-3-6-13(15)9-12/h3,5-6,9,11,17H,4,7-8,10H2,1-2H3,(H,16,18)/p+1/t11-/m0/s1