[(1S)-2-azaniumyl-1-(4-tert-butylphenyl)ethyl]-dibutyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(4-tert-butylphenyl)ethyl]-dibutyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(4-tert-butylphenyl)ethyl]-dibutyl-ammonium CAS Name: [(1S)-2-ammonio-1-(4-tert-butylphenyl)ethyl]-dibutylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(4-tert-butylphenyl)ethyl]-dibutylazanium Traditional Name: [(1S)-2-ammonio-1-(4-tert-butylphenyl)ethyl]-dibutyl-ammonium Formula: C20H38N2+2 MolecularWeight: 306.52912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H36N2/c1-6-8-14-22(15-9-7-2)19(16-21)17-10-12-18(13-11-17)20(3,4)5/h10-13,19H,6-9,14-16,21H2,1-5H3/p+2/t19-/m1/s1