[(2R)-3-(4-tert-butylphenoxy)-2-oxidanyl-propyl]-bis(2-methylpropyl)azanium

Systemtic Name: [(2R)-3-(4-tert-butylphenoxy)-2-oxidanyl-propyl]-bis(2-methylpropyl)azanium Openeye Name: [(2R)-3-(4-tert-butylphenoxy)-2-hydroxy-propyl]-diisobutyl-ammonium CAS Name: [(2R)-3-(4-tert-butylphenoxy)-2-hydroxypropyl]-bis(2-methylpropyl)ammonium IUPAC Name: [(2R)-3-(4-tert-butylphenoxy)-2-hydroxypropyl]-bis(2-methylpropyl)azanium Traditional Name: [(2R)-3-(4-tert-butylphenoxy)-2-hydroxy-propyl]-diisobutyl-ammonium Formula: C21H38NO2+ MolecularWeight: 336.53192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+](CC(C)C)CC(COC1=CC=C(C=C1)C(C)(C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C21H37NO2/c1-16(2)12-22(13-17(3)4)14-19(23)15-24-20-10-8-18(9-11-20)21(5,6)7/h8-11,16-17,19,23H,12-15H2,1-7H3/p+1/t19-/m1/s1