[(2S)-2-ethylhexyl]-[[1-(2-fluorophenyl)pyrrol-2-yl]methyl]azanium

Systemtic Name: [(2S)-2-ethylhexyl]-[[1-(2-fluorophenyl)pyrrol-2-yl]methyl]azanium Openeye Name: [(2S)-2-ethylhexyl]-[[1-(2-fluorophenyl)pyrrol-2-yl]methyl]ammonium CAS Name: [(2S)-2-ethylhexyl]-[[1-(2-fluorophenyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: [(2S)-2-ethylhexyl]-[[1-(2-fluorophenyl)pyrrol-2-yl]methyl]azanium Traditional Name: [(2S)-2-ethylhexyl]-[[1-(2-fluorophenyl)pyrrol-2-yl]methyl]ammonium Formula: C19H28FN2+ MolecularWeight: 303.437423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C[NH2+]CC1=CC=CN1C2=CC=CC=C2F

Isomeric SMILES

CCCC[C@H](CC)C[NH2+]CC1=CC=CN1C2=CC=CC=C2F

InChI

InChI=1S/C19H27FN2/c1-3-5-9-16(4-2)14-21-15-17-10-8-13-22(17)19-12-7-6-11-18(19)20/h6-8,10-13,16,21H,3-5,9,14-15H2,1-2H3/p+1/t16-/m0/s1