tert-butyl-[(2R)-3-(4-chloranylphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: tert-butyl-[(2R)-3-(4-chloranylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: tert-butyl-[(2R)-3-(4-chlorophenoxy)-2-hydroxy-propyl]ammonium CAS Name: tert-butyl-[(2R)-3-(4-chlorophenoxy)-2-hydroxypropyl]ammonium IUPAC Name: tert-butyl-[(2R)-3-(4-chlorophenoxy)-2-hydroxypropyl]azanium Traditional Name: tert-butyl-[(2R)-3-(4-chlorophenoxy)-2-hydroxy-propyl]ammonium Formula: C13H21ClNO2+ MolecularWeight: 258.76434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20ClNO2/c1-13(2,3)15-8-11(16)9-17-12-6-4-10(14)5-7-12/h4-7,11,15-16H,8-9H2,1-3H3/p+1/t11-/m1/s1