[(2R)-1-azaniumyl-2-methyl-octan-2-yl]-[(3-fluorophenyl)methyl]-methyl-azanium

Systemtic Name: [(2R)-1-azaniumyl-2-methyl-octan-2-yl]-[(3-fluorophenyl)methyl]-methyl-azanium Openeye Name: [(1R)-1-(azaniumylmethyl)-1-methyl-heptyl]-[(3-fluorophenyl)methyl]-methyl-ammonium CAS Name: [(2R)-1-ammonio-2-methyloctan-2-yl]-[(3-fluorophenyl)methyl]-methylammonium IUPAC Name: [(2R)-1-azaniumyl-2-methyloctan-2-yl]-[(3-fluorophenyl)methyl]-methylazanium Traditional Name: [(1R)-1-(ammoniomethyl)-1-methyl-heptyl]-(3-fluorobenzyl)-methyl-ammonium Formula: C17H31FN2+2 MolecularWeight: 282.439843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C[NH3+])[NH+](C)CC1=CC(=CC=C1)F

Isomeric SMILES

CCCCCC[C@](C)(C[NH3+])[NH+](C)CC1=CC(=CC=C1)F

InChI

InChI=1S/C17H29FN2/c1-4-5-6-7-11-17(2,14-19)20(3)13-15-9-8-10-16(18)12-15/h8-10,12H,4-7,11,13-14,19H2,1-3H3/p+2/t17-/m1/s1