[3-[(E)-8-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-1-oxidanyl-1-[3-(trifluoromethyl)phenyl]oct-3-en-2-yl]-4-oxidanylidene-7-sulfanylidene-6H-chromen-2-yl] methyl carbonate

Systemtic Name: [3-[(E)-8-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-1-oxidanyl-1-[3-(trifluoromethyl)phenyl]oct-3-en-2-yl]-4-oxidanylidene-7-sulfanylidene-6H-chromen-2-yl] methyl carbonate Openeye Name: [3-[(E)-7-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-1-[hydroxy-[3-(trifluoromethyl)phenyl]methyl]hept-2-enyl]-4-oxo-7-thioxo-6H-chromen-2-yl] methyl carbonate CAS Name: carbonic acid [3-[(E)-8-(4-acetyl-3-hydroxy-2-propylphenoxy)-1-hydroxy-1-[3-(trifluoromethyl)phenyl]oct-3-en-2-yl]-4-oxo-7-sulfanylidene-6H-1-benzopyran-2-yl] methyl ester IUPAC Name: [3-[(E)-8-(4-acetyl-3-hydroxy-2-propylphenoxy)-1-hydroxy-1-[3-(trifluoromethyl)phenyl]oct-3-en-2-yl]-4-oxo-7-sulfanylidene-6H-chromen-2-yl] methyl carbonate Traditional Name: carbonic acid [3-[(E)-7-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-1-[hydroxy-[3-(trifluoromethyl)phenyl]methyl]hept-2-enyl]-4-keto-7-thioxo-6H-chromen-2-yl] methyl ester Formula: C37H37F3O9S MolecularWeight: 714.74449

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCC=CC(C2=C(OC3=CC(=S)CC=C3C2=O)OC(=O)OC)C(C4=CC(=CC=C4)C(F)(F)F)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCC/C=C/C(C2=C(OC3=CC(=S)CC=C3C2=O)OC(=O)OC)C(C4=CC(=CC=C4)C(F)(F)F)O

InChI

InChI=1S/C37H37F3O9S/c1-4-10-26-29(17-16-25(21(2)41)33(26)43)47-18-8-6-5-7-13-28(32(42)22-11-9-12-23(19-22)37(38,39)40)31-34(44)27-15-14-24(50)20-30(27)48-35(31)49-36(45)46-3/h7,9,11-13,15-17,19-20,28,32,42-43H,4-6,8,10,14,18H2,1-3H3/b13-7+