3-[(2-cyano-3-fluoranyl-phenyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(2-cyano-3-fluoranyl-phenyl)amino]propyl-dimethyl-azanium Openeye Name: 3-(2-cyano-3-fluoro-anilino)propyl-dimethyl-ammonium CAS Name: 3-(2-cyano-3-fluoroanilino)propyl-dimethylammonium IUPAC Name: 3-(2-cyano-3-fluoroanilino)propyl-dimethylazanium Traditional Name: 3-(2-cyano-3-fluoro-anilino)propyl-dimethyl-ammonium Formula: C12H17FN3+ MolecularWeight: 222.281883

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=C(C(=CC=C1)F)C#N

Isomeric SMILES

C[NH+](C)CCCNC1=C(C(=CC=C1)F)C#N

InChI

InChI=1S/C12H16FN3/c1-16(2)8-4-7-15-12-6-3-5-11(13)10(12)9-14/h3,5-6,15H,4,7-8H2,1-2H3/p+1