[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl-pentyl-azanium

Systemtic Name: [1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl-pentyl-azanium Openeye Name: [1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl-pentyl-ammonium CAS Name: [1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl-pentylammonium IUPAC Name: [1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl-pentylazanium Traditional Name: amyl-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]ammonium Formula: C17H24FN2+ MolecularWeight: 275.384263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH2+]CC1=CC=CN1CC2=CC(=CC=C2)F

Isomeric SMILES

CCCCC[NH2+]CC1=CC=CN1CC2=CC(=CC=C2)F

InChI

InChI=1S/C17H23FN2/c1-2-3-4-10-19-13-17-9-6-11-20(17)14-15-7-5-8-16(18)12-15/h5-9,11-12,19H,2-4,10,13-14H2,1H3/p+1