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

Systemtic Name: [1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl-(2-methylpropyl)azanium Openeye Name: [1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl-isobutyl-ammonium CAS Name: [1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl-(2-methylpropyl)ammonium IUPAC Name: [1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl-(2-methylpropyl)azanium Traditional Name: [1-(3-fluorobenzyl)pyrrol-2-yl]methyl-isobutyl-ammonium Formula: C16H22FN2+ MolecularWeight: 261.357683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21FN2/c1-13(2)10-18-11-16-7-4-8-19(16)12-14-5-3-6-15(17)9-14/h3-9,13,18H,10-12H2,1-2H3/p+1