4-[(2-fluorophenyl)methyl-methyl-azaniumyl]butanoate

Systemtic Name: 4-[(2-fluorophenyl)methyl-methyl-azaniumyl]butanoate Openeye Name: 4-[(2-fluorophenyl)methyl-methyl-ammonio]butanoate CAS Name: 4-[(2-fluorophenyl)methyl-methylammonio]butanoate IUPAC Name: 4-[(2-fluorophenyl)methyl-methylazaniumyl]butanoate Traditional Name: 4-[(2-fluorobenzyl)-methyl-ammonio]butyrate Formula: C12H16FNO2 MolecularWeight: 225.259343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCC(=O)[O-])CC1=CC=CC=C1F

Isomeric SMILES

C[NH+](CCCC(=O)[O-])CC1=CC=CC=C1F

InChI

InChI=1S/C12H16FNO2/c1-14(8-4-7-12(15)16)9-10-5-2-3-6-11(10)13/h2-3,5-6H,4,7-9H2,1H3,(H,15,16)