[(1S)-2-azaniumyl-1-[2,4-bis(oxidanyl)phenyl]ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-[2,4-bis(oxidanyl)phenyl]ethyl]-diethyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(2,4-dihydroxyphenyl)ethyl]-diethyl-ammonium CAS Name: [(1S)-2-ammonio-1-(2,4-dihydroxyphenyl)ethyl]-diethylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(2,4-dihydroxyphenyl)ethyl]-diethylazanium Traditional Name: [(1S)-2-ammonio-1-(2,4-dihydroxyphenyl)ethyl]-diethyl-ammonium Formula: C12H22N2O2+2 MolecularWeight: 226.31528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N2O2/c1-3-14(4-2)11(8-13)10-6-5-9(15)7-12(10)16/h5-7,11,15-16H,3-4,8,13H2,1-2H3/p+2/t11-/m1/s1