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

Systemtic Name: [(1S)-2-azaniumyl-1-(4-dimethylaminophenyl)ethyl]-dibutyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(4-dimethylaminophenyl)ethyl]-dibutyl-ammonium CAS Name: [(1S)-2-ammonio-1-(4-dimethylaminophenyl)ethyl]-dibutylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(4-dimethylaminophenyl)ethyl]-dibutylazanium Traditional Name: [(1S)-2-ammonio-1-(4-dimethylaminophenyl)ethyl]-dibutyl-ammonium Formula: C18H35N3+2 MolecularWeight: 293.4906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H33N3/c1-5-7-13-21(14-8-6-2)18(15-19)16-9-11-17(12-10-16)20(3)4/h9-12,18H,5-8,13-15,19H2,1-4H3/p+2/t18-/m1/s1