3-butoxypropyl-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]azanium

Systemtic Name: 3-butoxypropyl-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]azanium Openeye Name: 3-butoxypropyl-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: 3-butoxypropyl-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]ammonium IUPAC Name: 3-butoxypropyl-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]azanium Traditional Name: 3-butoxypropyl-[[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C17H25FN3O+ MolecularWeight: 306.398303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCC[NH2+]CC1=C(NN=C1)C2=CC=C(C=C2)F

Isomeric SMILES

CCCCOCCC[NH2+]CC1=C(NN=C1)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H24FN3O/c1-2-3-10-22-11-4-9-19-12-15-13-20-21-17(15)14-5-7-16(18)8-6-14/h5-8,13,19H,2-4,9-12H2,1H3,(H,20,21)/p+1