[(1R)-2-azaniumyl-1-(5-chloranyl-2-propoxy-phenyl)ethyl]-tert-butyl-ethyl-azanium

Systemtic Name: [(1R)-2-azaniumyl-1-(5-chloranyl-2-propoxy-phenyl)ethyl]-tert-butyl-ethyl-azanium Openeye Name: [(1R)-2-azaniumyl-1-(5-chloro-2-propoxy-phenyl)ethyl]-tert-butyl-ethyl-ammonium CAS Name: [(1R)-2-ammonio-1-(5-chloro-2-propoxyphenyl)ethyl]-tert-butyl-ethylammonium IUPAC Name: [(1R)-2-azaniumyl-1-(5-chloro-2-propoxyphenyl)ethyl]-tert-butyl-ethylazanium Traditional Name: [(1R)-2-ammonio-1-(5-chloro-2-propoxy-phenyl)ethyl]-tert-butyl-ethyl-ammonium Formula: C17H31ClN2O+2 MolecularWeight: 314.89384

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Cl)C(C[NH3+])[NH+](CC)C(C)(C)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Cl)[C@H](C[NH3+])[NH+](CC)C(C)(C)C

InChI

InChI=1S/C17H29ClN2O/c1-6-10-21-16-9-8-13(18)11-14(16)15(12-19)20(7-2)17(3,4)5/h8-9,11,15H,6-7,10,12,19H2,1-5H3/p+2/t15-/m0/s1