[(1S)-2-azaniumyl-1-(4-methylphenyl)ethyl]-bis(2-methylpropyl)azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(4-methylphenyl)ethyl]-bis(2-methylpropyl)azanium Openeye Name: [(1S)-2-azaniumyl-1-(p-tolyl)ethyl]-diisobutyl-ammonium CAS Name: [(1S)-2-ammonio-1-(4-methylphenyl)ethyl]-bis(2-methylpropyl)ammonium IUPAC Name: [(1S)-2-azaniumyl-1-(4-methylphenyl)ethyl]-bis(2-methylpropyl)azanium Traditional Name: [(1S)-2-ammonio-1-(p-tolyl)ethyl]-diisobutyl-ammonium Formula: C17H32N2+2 MolecularWeight: 264.44938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H30N2/c1-13(2)11-19(12-14(3)4)17(10-18)16-8-6-15(5)7-9-16/h6-9,13-14,17H,10-12,18H2,1-5H3/p+2/t17-/m1/s1