ethyl 2-[8-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propylsulfanylmethyl]-6,9-dithiaspiro[4.4]nonan-3-yl]ethanoate

Systemtic Name: ethyl 2-[8-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propylsulfanylmethyl]-6,9-dithiaspiro[4.4]nonan-3-yl]ethanoate Openeye Name: ethyl 2-[8-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylsulfanylmethyl]-6,9-dithiaspiro[4.4]nonan-3-yl]acetate CAS Name: 2-[8-[[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylthio]methyl]-6,9-dithiaspiro[4.4]nonan-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[8-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propylsulfanylmethyl]-6,9-dithiaspiro[4.4]nonan-3-yl]acetate Traditional Name: 2-[8-[[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propylthio]methyl]-6,9-dithiaspiro[4.4]nonan-3-yl]acetic acid ethyl ester Formula: C26H38O5S3 MolecularWeight: 526.77192

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSCC2CSC3(S2)CCC(C3)CC(=O)OCC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCSCC2CSC3(S2)CCC(C3)CC(=O)OCC

InChI

InChI=1S/C26H38O5S3/c1-4-7-22-23(9-8-21(18(3)27)25(22)29)31-12-6-13-32-16-20-17-33-26(34-20)11-10-19(15-26)14-24(28)30-5-2/h8-9,19-20,29H,4-7,10-17H2,1-3H3