4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-2-methylsulfinyl-phenol

Systemtic Name: 4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-2-methylsulfinyl-phenol Openeye Name: 4-[3-(tert-butylamino)-2-hydroxy-propoxy]-2-methylsulfinyl-phenol CAS Name: 4-[3-(tert-butylamino)-2-hydroxypropoxy]-2-methylsulfinylphenol IUPAC Name: 4-[3-(tert-butylamino)-2-hydroxypropoxy]-2-methylsulfinylphenol Traditional Name: 4-[3-(tert-butylamino)-2-hydroxy-propoxy]-2-methylsulfinyl-phenol Formula: C14H23NO4S MolecularWeight: 301.40172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC(=C(C=C1)O)S(=O)C)O

Isomeric SMILES

CC(C)(C)NCC(COC1=CC(=C(C=C1)O)S(=O)C)O

InChI

InChI=1S/C14H23NO4S/c1-14(2,3)15-8-10(16)9-19-11-5-6-12(17)13(7-11)20(4)18/h5-7,10,15-17H,8-9H2,1-4H3