[(2R)-1-azaniumyl-2,4-dimethyl-pentan-2-yl]-methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: [(2R)-1-azaniumyl-2,4-dimethyl-pentan-2-yl]-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [(1R)-1-(azaniumylmethyl)-1,3-dimethyl-butyl]-methyl-(p-tolylmethyl)ammonium CAS Name: [(2R)-1-ammonio-2,4-dimethylpentan-2-yl]-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [(2R)-1-azaniumyl-2,4-dimethylpentan-2-yl]-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [(1R)-1-(ammoniomethyl)-1,3-dimethyl-butyl]-methyl-(4-methylbenzyl)ammonium Formula: C16H30N2+2 MolecularWeight: 250.4228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2/c1-13(2)10-16(4,12-17)18(5)11-15-8-6-14(3)7-9-15/h6-9,13H,10-12,17H2,1-5H3/p+2/t16-/m1/s1