3-cyanopropyl-[(3-fluorophenyl)methyl]-methyl-azanium

Systemtic Name: 3-cyanopropyl-[(3-fluorophenyl)methyl]-methyl-azanium Openeye Name: 3-cyanopropyl-[(3-fluorophenyl)methyl]-methyl-ammonium CAS Name: 3-cyanopropyl-[(3-fluorophenyl)methyl]-methylammonium IUPAC Name: 3-cyanopropyl-[(3-fluorophenyl)methyl]-methylazanium Traditional Name: 3-cyanopropyl-(3-fluorobenzyl)-methyl-ammonium Formula: C12H16FN2+ MolecularWeight: 207.267243

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCC#N)CC1=CC(=CC=C1)F

Isomeric SMILES

C[NH+](CCCC#N)CC1=CC(=CC=C1)F

InChI

InChI=1S/C12H15FN2/c1-15(8-3-2-7-14)10-11-5-4-6-12(13)9-11/h4-6,9H,2-3,8,10H2,1H3/p+1