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

Systemtic Name: [(1S)-2-azaniumyl-1-(2-ethoxyphenyl)ethyl]-dibutyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(2-ethoxyphenyl)ethyl]-dibutyl-ammonium CAS Name: [(1S)-2-ammonio-1-(2-ethoxyphenyl)ethyl]-dibutylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(2-ethoxyphenyl)ethyl]-dibutylazanium Traditional Name: [(1S)-2-ammonio-1-o-phenetyl-ethyl]-dibutyl-ammonium Formula: C18H34N2O+2 MolecularWeight: 294.47536

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)C(C[NH3+])C1=CC=CC=C1OCC

Isomeric SMILES

CCCC[NH+](CCCC)[C@H](C[NH3+])C1=CC=CC=C1OCC

InChI

InChI=1S/C18H32N2O/c1-4-7-13-20(14-8-5-2)17(15-19)16-11-9-10-12-18(16)21-6-3/h9-12,17H,4-8,13-15,19H2,1-3H3/p+2/t17-/m1/s1