[(1S)-2-azaniumyl-1-(5-chloranyl-2-oxidanyl-phenyl)ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(5-chloranyl-2-oxidanyl-phenyl)ethyl]-diethyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(5-chloro-2-hydroxy-phenyl)ethyl]-diethyl-ammonium CAS Name: [(1S)-2-ammonio-1-(5-chloro-2-hydroxyphenyl)ethyl]-diethylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(5-chloro-2-hydroxyphenyl)ethyl]-diethylazanium Traditional Name: [(1S)-2-ammonio-1-(5-chloro-2-hydroxy-phenyl)ethyl]-diethyl-ammonium Formula: C12H21ClN2O+2 MolecularWeight: 244.76094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19ClN2O/c1-3-15(4-2)11(8-14)10-7-9(13)5-6-12(10)16/h5-7,11,16H,3-4,8,14H2,1-2H3/p+2/t11-/m1/s1