[(2R)-3-(2-tert-butyl-4-ethyl-phenoxy)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2R)-3-(2-tert-butyl-4-ethyl-phenoxy)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2R)-3-(2-tert-butyl-4-ethyl-phenoxy)-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2R)-3-(2-tert-butyl-4-ethylphenoxy)-2-hydroxypropyl]-methylammonium IUPAC Name: [(2R)-3-(2-tert-butyl-4-ethylphenoxy)-2-hydroxypropyl]-methylazanium Traditional Name: [(2R)-3-(2-tert-butyl-4-ethyl-phenoxy)-2-hydroxy-propyl]-methyl-ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(C[NH2+]C)O)C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1)OC[C@@H](C[NH2+]C)O)C(C)(C)C

InChI

InChI=1S/C16H27NO2/c1-6-12-7-8-15(14(9-12)16(2,3)4)19-11-13(18)10-17-5/h7-9,13,17-18H,6,10-11H2,1-5H3/p+1/t13-/m1/s1