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

Systemtic Name: [3-[(E)-6-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-1-oxidanyl-1-[3-(trifluoromethyl)phenyl]hex-3-en-2-yl]-4-oxidanylidene-7-sulfanylidene-6H-chromen-2-yl] methyl carbonate Openeye Name: [3-[(E)-5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-1-[hydroxy-[3-(trifluoromethyl)phenyl]methyl]pent-2-enyl]-4-oxo-7-thioxo-6H-chromen-2-yl] methyl carbonate CAS Name: carbonic acid [3-[(E)-6-(4-acetyl-3-hydroxy-2-propylphenoxy)-1-hydroxy-1-[3-(trifluoromethyl)phenyl]hex-3-en-2-yl]-4-oxo-7-sulfanylidene-6H-1-benzopyran-2-yl] methyl ester IUPAC Name: [3-[(E)-6-(4-acetyl-3-hydroxy-2-propylphenoxy)-1-hydroxy-1-[3-(trifluoromethyl)phenyl]hex-3-en-2-yl]-4-oxo-7-sulfanylidene-6H-chromen-2-yl] methyl carbonate Traditional Name: carbonic acid [3-[(E)-5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-1-[hydroxy-[3-(trifluoromethyl)phenyl]methyl]pent-2-enyl]-4-keto-7-thioxo-6H-chromen-2-yl] methyl ester Formula: C35H33F3O9S MolecularWeight: 686.69133

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCC=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)OCC/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/C35H33F3O9S/c1-4-8-24-27(15-14-23(19(2)39)31(24)41)45-16-6-5-11-26(30(40)20-9-7-10-21(17-20)35(36,37)38)29-32(42)25-13-12-22(48)18-28(25)46-33(29)47-34(43)44-3/h5,7,9-11,13-15,17-18,26,30,40-41H,4,6,8,12,16H2,1-3H3/b11-5+