N-(4-methylsulfanyl-1-oxidanyl-butan-2-yl)-2-(4-oxidanylidenespiro[3H-chromene-2,1'-cyclohexane]-7-yl)oxy-ethanamide

Systemtic Name: N-(4-methylsulfanyl-1-oxidanyl-butan-2-yl)-2-(4-oxidanylidenespiro[3H-chromene-2,1'-cyclohexane]-7-yl)oxy-ethanamide Openeye Name: N-[1-(hydroxymethyl)-3-methylsulfanyl-propyl]-2-(4-oxospiro[chromane-2,1'-cyclohexane]-7-yl)oxy-acetamide CAS Name: N-[1-hydroxy-4-(methylthio)butan-2-yl]-2-[(4-oxo-7-spiro[3,4-dihydro-2H-1-benzopyran-2,1'-cyclohexane]yl)oxy]acetamide IUPAC Name: N-(1-hydroxy-4-methylsulfanylbutan-2-yl)-2-(4-oxospiro[3H-chromene-2,1'-cyclohexane]-7-yl)oxyacetamide Traditional Name: 2-(4-ketospiro[chroman-2,1'-cyclohexane]-7-yl)oxy-N-[1-methylol-3-(methylthio)propyl]acetamide Formula: C21H29NO5S MolecularWeight: 407.52366

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(CO)NC(=O)COC1=CC2=C(C=C1)C(=O)CC3(O2)CCCCC3

Isomeric SMILES

CSCCC(CO)NC(=O)COC1=CC2=C(C=C1)C(=O)CC3(O2)CCCCC3

InChI

InChI=1S/C21H29NO5S/c1-28-10-7-15(13-23)22-20(25)14-26-16-5-6-17-18(24)12-21(27-19(17)11-16)8-3-2-4-9-21/h5-6,11,15,23H,2-4,7-10,12-14H2,1H3,(H,22,25)