4-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(hydroxymethyl)phenol nitrate

Systemtic Name: 4-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(hydroxymethyl)phenol nitrate Openeye Name: 4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-(hydroxymethyl)phenol nitrate CAS Name: 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol nitrate IUPAC Name: 4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol nitrate Traditional Name: 4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol nitrate Formula: C13H21N2O6- MolecularWeight: 301.31564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)O.[N+](=O)([O-])[O-]

Isomeric SMILES

CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)O.[N+](=O)([O-])[O-]

InChI

InChI=1S/C13H21NO3.NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15;2-1(3)4/h4-6,12,14-17H,7-8H2,1-3H3;/q;-1