tert-butyl-[3-(2-cyanophenoxy)-2-oxidanyl-propyl]azanium chloride

Systemtic Name: tert-butyl-[3-(2-cyanophenoxy)-2-oxidanyl-propyl]azanium chloride Openeye Name: tert-butyl-[3-(2-cyanophenoxy)-2-hydroxy-propyl]ammonium chloride CAS Name: tert-butyl-[3-(2-cyanophenoxy)-2-hydroxypropyl]ammonium chloride IUPAC Name: tert-butyl-[3-(2-cyanophenoxy)-2-hydroxypropyl]azanium chloride Traditional Name: tert-butyl-[3-(2-cyanophenoxy)-2-hydroxy-propyl]ammonium chloride Formula: C14H21ClN2O2 MolecularWeight: 284.78174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(COC1=CC=CC=C1C#N)O.[Cl-]

Isomeric SMILES

CC(C)(C)[NH2+]CC(COC1=CC=CC=C1C#N)O.[Cl-]

InChI

InChI=1S/C14H20N2O2.ClH/c1-14(2,3)16-9-12(17)10-18-13-7-5-4-6-11(13)8-15;/h4-7,12,16-17H,9-10H2,1-3H3;1H