(3-fluorophenyl)methyl-[(1-methylpyrazol-4-yl)methyl]azanium

Systemtic Name: (3-fluorophenyl)methyl-[(1-methylpyrazol-4-yl)methyl]azanium Openeye Name: (3-fluorophenyl)methyl-[(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: (3-fluorophenyl)methyl-[(1-methyl-4-pyrazolyl)methyl]ammonium IUPAC Name: (3-fluorophenyl)methyl-[(1-methylpyrazol-4-yl)methyl]azanium Traditional Name: (3-fluorobenzyl)-[(1-methylpyrazol-4-yl)methyl]ammonium Formula: C12H15FN3+ MolecularWeight: 220.266003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C[NH2+]CC2=CC(=CC=C2)F

Isomeric SMILES

CN1C=C(C=N1)C[NH2+]CC2=CC(=CC=C2)F

InChI

InChI=1S/C12H14FN3/c1-16-9-11(8-15-16)7-14-6-10-3-2-4-12(13)5-10/h2-5,8-9,14H,6-7H2,1H3/p+1