[(1S)-2-azaniumyl-1-(2,4,6-trimethylphenyl)ethyl]-butyl-methyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(2,4,6-trimethylphenyl)ethyl]-butyl-methyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(2,4,6-trimethylphenyl)ethyl]-butyl-methyl-ammonium CAS Name: [(1S)-2-ammonio-1-(2,4,6-trimethylphenyl)ethyl]-butyl-methylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(2,4,6-trimethylphenyl)ethyl]-butyl-methylazanium Traditional Name: [(1S)-2-ammonio-1-mesityl-ethyl]-butyl-methyl-ammonium Formula: C16H30N2+2 MolecularWeight: 250.4228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C(C[NH3+])C1=C(C=C(C=C1C)C)C

Isomeric SMILES

CCCC[NH+](C)[C@H](C[NH3+])C1=C(C=C(C=C1C)C)C

InChI

InChI=1S/C16H28N2/c1-6-7-8-18(5)15(11-17)16-13(3)9-12(2)10-14(16)4/h9-10,15H,6-8,11,17H2,1-5H3/p+2/t15-/m1/s1