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

Systemtic Name: [(1S)-2-azaniumyl-1-(2-propoxyphenyl)ethyl]-dibutyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(2-propoxyphenyl)ethyl]-dibutyl-ammonium CAS Name: [(1S)-2-ammonio-1-(2-propoxyphenyl)ethyl]-dibutylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(2-propoxyphenyl)ethyl]-dibutylazanium Traditional Name: [(1S)-2-ammonio-1-(2-propoxyphenyl)ethyl]-dibutyl-ammonium Formula: C19H36N2O+2 MolecularWeight: 308.50194

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)C(C[NH3+])C1=CC=CC=C1OCCC

Isomeric SMILES

CCCC[NH+](CCCC)[C@H](C[NH3+])C1=CC=CC=C1OCCC

InChI

InChI=1S/C19H34N2O/c1-4-7-13-21(14-8-5-2)18(16-20)17-11-9-10-12-19(17)22-15-6-3/h9-12,18H,4-8,13-16,20H2,1-3H3/p+2/t18-/m1/s1