[(2R)-1-azaniumyl-4-methyl-pentan-2-yl]-[(3-fluorophenyl)methyl]-methyl-azanium

Systemtic Name: [(2R)-1-azaniumyl-4-methyl-pentan-2-yl]-[(3-fluorophenyl)methyl]-methyl-azanium Openeye Name: [(1R)-1-(azaniumylmethyl)-3-methyl-butyl]-[(3-fluorophenyl)methyl]-methyl-ammonium CAS Name: [(2R)-1-ammonio-4-methylpentan-2-yl]-[(3-fluorophenyl)methyl]-methylammonium IUPAC Name: [(2R)-1-azaniumyl-4-methylpentan-2-yl]-[(3-fluorophenyl)methyl]-methylazanium Traditional Name: [(1R)-1-(ammoniomethyl)-3-methyl-butyl]-(3-fluorobenzyl)-methyl-ammonium Formula: C14H25FN2+2 MolecularWeight: 240.360103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23FN2/c1-11(2)7-14(9-16)17(3)10-12-5-4-6-13(15)8-12/h4-6,8,11,14H,7,9-10,16H2,1-3H3/p+2/t14-/m1/s1