[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]-ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium

Systemtic Name: [(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]-ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]azanium Openeye Name: [(1S)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl]-ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]ammonium CAS Name: [(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]-ethyl-[(3-fluoro-4-methoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]-ethyl-[(3-fluoro-4-methoxyphenyl)methyl]azanium Traditional Name: [(1S)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl]-ethyl-(3-fluoro-4-methoxy-benzyl)ammonium Formula: C16H24FN2O2+ MolecularWeight: 295.372363

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=C(C=C1)OC)F)C(C)C(=O)NC2CC2

Isomeric SMILES

CC[NH+](CC1=CC(=C(C=C1)OC)F)[C@@H](C)C(=O)NC2CC2

InChI

InChI=1S/C16H23FN2O2/c1-4-19(11(2)16(20)18-13-6-7-13)10-12-5-8-15(21-3)14(17)9-12/h5,8-9,11,13H,4,6-7,10H2,1-3H3,(H,18,20)/p+1/t11-/m0/s1