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

Systemtic Name: [(2R)-3-(4-tert-butylphenoxy)-2-oxidanyl-propyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(2R)-3-(4-tert-butylphenoxy)-2-hydroxy-propyl]ammonium CAS Name: [(2R)-3-(4-tert-butylphenoxy)-2-hydroxypropyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2R)-3-(4-tert-butylphenoxy)-2-hydroxypropyl]azanium Traditional Name: benzyl-[(2R)-3-(4-tert-butylphenoxy)-2-hydroxy-propyl]ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(C[NH2+]CC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC[C@@H](C[NH2+]CC2=CC=CC=C2)O

InChI

InChI=1S/C20H27NO2/c1-20(2,3)17-9-11-19(12-10-17)23-15-18(22)14-21-13-16-7-5-4-6-8-16/h4-12,18,21-22H,13-15H2,1-3H3/p+1/t18-/m1/s1