4-[(1R)-2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(hydroxymethyl)phenol; ethanoic acid

Systemtic Name: 4-[(1R)-2-(tert-butylamino)-1-oxidanyl-ethyl]-2-(hydroxymethyl)phenol; ethanoic acid Openeye Name: acetic acid; 4-[(1R)-2-(tert-butylamino)-1-hydroxy-ethyl]-2-(hydroxymethyl)phenol CAS Name: acetic acid; 4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol IUPAC Name: acetic acid; 4-[(1R)-2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol Traditional Name: acetic acid; 4-[(1R)-2-(tert-butylamino)-1-hydroxy-ethyl]-2-methylol-phenol Formula: C15H25NO5 MolecularWeight: 299.3627

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)O

Isomeric SMILES

CC(=O)O.CC(C)(C)NC[C@@H](C1=CC(=C(C=C1)O)CO)O

InChI

InChI=1S/C13H21NO3.C2H4O2/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15;1-2(3)4/h4-6,12,14-17H,7-8H2,1-3H3;1H3,(H,3,4)/t12-;/m0./s1