[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl-[(2R)-2-oxidanylbutyl]-prop-2-enyl-azanium

Systemtic Name: [1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl-[(2R)-2-oxidanylbutyl]-prop-2-enyl-azanium Openeye Name: allyl-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl]-[(2R)-2-hydroxybutyl]ammonium CAS Name: [1-[(2-fluorophenyl)methyl]-2-pyrrolyl]methyl-[(2R)-2-hydroxybutyl]-prop-2-enylammonium IUPAC Name: [1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl-[(2R)-2-hydroxybutyl]-prop-2-enylazanium Traditional Name: allyl-[[1-(2-fluorobenzyl)pyrrol-2-yl]methyl]-[(2R)-2-hydroxybutyl]ammonium Formula: C19H26FN2O+ MolecularWeight: 317.420943

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C[NH+](CC=C)CC1=CC=CN1CC2=CC=CC=C2F)O

Isomeric SMILES

CC[C@H](C[NH+](CC=C)CC1=CC=CN1CC2=CC=CC=C2F)O

InChI

InChI=1S/C19H25FN2O/c1-3-11-21(15-18(23)4-2)14-17-9-7-12-22(17)13-16-8-5-6-10-19(16)20/h3,5-10,12,18,23H,1,4,11,13-15H2,2H3/p+1/t18-/m1/s1