3-[[(S)-cyano-(2-fluorophenyl)methyl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(S)-cyano-(2-fluorophenyl)methyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(S)-cyano-(2-fluorophenyl)methyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(S)-cyano-(2-fluorophenyl)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(S)-cyano-(2-fluorophenyl)methyl]amino]propyl-dimethylazanium Traditional Name: 3-[[(S)-cyano-(2-fluorophenyl)methyl]amino]propyl-dimethyl-ammonium Formula: C13H19FN3+ MolecularWeight: 236.308463

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(C#N)C1=CC=CC=C1F

Isomeric SMILES

C[NH+](C)CCCN[C@H](C#N)C1=CC=CC=C1F

InChI

InChI=1S/C13H18FN3/c1-17(2)9-5-8-16-13(10-15)11-6-3-4-7-12(11)14/h3-4,6-7,13,16H,5,8-9H2,1-2H3/p+1/t13-/m1/s1