[(2R)-butan-2-yl]-[(2R)-3-(4-ethoxyphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: [(2R)-butan-2-yl]-[(2R)-3-(4-ethoxyphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: [(2R)-3-(4-ethoxyphenoxy)-2-hydroxy-propyl]-[(1R)-1-methylpropyl]ammonium CAS Name: [(2R)-butan-2-yl]-[(2R)-3-(4-ethoxyphenoxy)-2-hydroxypropyl]ammonium IUPAC Name: [(2R)-butan-2-yl]-[(2R)-3-(4-ethoxyphenoxy)-2-hydroxypropyl]azanium Traditional Name: [(2R)-3-(4-ethoxyphenoxy)-2-hydroxy-propyl]-[(1R)-1-methylpropyl]ammonium Formula: C15H26NO3+ MolecularWeight: 268.37184

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC(COC1=CC=C(C=C1)OCC)O

Isomeric SMILES

CC[C@@H](C)[NH2+]C[C@H](COC1=CC=C(C=C1)OCC)O

InChI

InChI=1S/C15H25NO3/c1-4-12(3)16-10-13(17)11-19-15-8-6-14(7-9-15)18-5-2/h6-9,12-13,16-17H,4-5,10-11H2,1-3H3/p+1/t12-,13-/m1/s1