methyl-[(2R)-3-[4-(2-methylbutan-2-yl)phenoxy]-2-oxidanyl-propyl]azanium

Systemtic Name: methyl-[(2R)-3-[4-(2-methylbutan-2-yl)phenoxy]-2-oxidanyl-propyl]azanium Openeye Name: [(2R)-3-[4-(1,1-dimethylpropyl)phenoxy]-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2R)-2-hydroxy-3-[4-(2-methylbutan-2-yl)phenoxy]propyl]-methylammonium IUPAC Name: [(2R)-2-hydroxy-3-[4-(2-methylbutan-2-yl)phenoxy]propyl]-methylazanium Traditional Name: [(2R)-3-(4-tert-amylphenoxy)-2-hydroxy-propyl]-methyl-ammonium Formula: C15H26NO2+ MolecularWeight: 252.37244

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCC(C[NH2+]C)O

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC[C@@H](C[NH2+]C)O

InChI

InChI=1S/C15H25NO2/c1-5-15(2,3)12-6-8-14(9-7-12)18-11-13(17)10-16-4/h6-9,13,16-17H,5,10-11H2,1-4H3/p+1/t13-/m1/s1