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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2/c1-5-15(6-2)16(11-17)18(4)12-14-9-7-13(3)8-10-14/h7-10,15-16H,5-6,11-12,17H2,1-4H3/p+2/t16-/m0/s1