[(1S)-2-azaniumyl-1-(4-hydroxyphenyl)ethyl]-butyl-methyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(4-hydroxyphenyl)ethyl]-butyl-methyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(4-hydroxyphenyl)ethyl]-butyl-methyl-ammonium CAS Name: [(1S)-2-ammonio-1-(4-hydroxyphenyl)ethyl]-butyl-methylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(4-hydroxyphenyl)ethyl]-butyl-methylazanium Traditional Name: [(1S)-2-ammonio-1-(4-hydroxyphenyl)ethyl]-butyl-methyl-ammonium Formula: C13H24N2O+2 MolecularWeight: 224.34246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N2O/c1-3-4-9-15(2)13(10-14)11-5-7-12(16)8-6-11/h5-8,13,16H,3-4,9-10,14H2,1-2H3/p+2/t13-/m1/s1