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

Systemtic Name: [(2R)-1-azaniumyl-3-ethyl-pentan-2-yl]-[(3-fluorophenyl)methyl]-methyl-azanium Openeye Name: [(1R)-1-(azaniumylmethyl)-2-ethyl-butyl]-[(3-fluorophenyl)methyl]-methyl-ammonium CAS Name: [(2R)-1-ammonio-3-ethylpentan-2-yl]-[(3-fluorophenyl)methyl]-methylammonium IUPAC Name: [(2R)-1-azaniumyl-3-ethylpentan-2-yl]-[(3-fluorophenyl)methyl]-methylazanium Traditional Name: [(1R)-1-(ammoniomethyl)-2-ethyl-butyl]-(3-fluorobenzyl)-methyl-ammonium Formula: C15H27FN2+2 MolecularWeight: 254.386683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25FN2/c1-4-13(5-2)15(10-17)18(3)11-12-7-6-8-14(16)9-12/h6-9,13,15H,4-5,10-11,17H2,1-3H3/p+2/t15-/m0/s1