[(2R)-1-azaniumylbutan-2-yl]-methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: [(2R)-1-azaniumylbutan-2-yl]-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [(1R)-1-(azaniumylmethyl)propyl]-methyl-(p-tolylmethyl)ammonium CAS Name: [(2R)-1-ammoniobutan-2-yl]-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [(2R)-1-azaniumylbutan-2-yl]-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [(1R)-1-(ammoniomethyl)propyl]-methyl-(4-methylbenzyl)ammonium Formula: C13H24N2+2 MolecularWeight: 208.34306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N2/c1-4-13(9-14)15(3)10-12-7-5-11(2)6-8-12/h5-8,13H,4,9-10,14H2,1-3H3/p+2/t13-/m1/s1