methyl [4-oxidanylidene-3-[(3E,5E)-1-oxidanyl-1-[3-(trifluoromethyl)phenyl]hexadeca-3,5-dien-2-yl]sulfanyl-chromen-2-yl] carbonate

Systemtic Name: methyl [4-oxidanylidene-3-[(3E,5E)-1-oxidanyl-1-[3-(trifluoromethyl)phenyl]hexadeca-3,5-dien-2-yl]sulfanyl-chromen-2-yl] carbonate Openeye Name: [3-[(2E,4E)-1-[hydroxy-[3-(trifluoromethyl)phenyl]methyl]pentadeca-2,4-dienyl]sulfanyl-4-oxo-chromen-2-yl] methyl carbonate CAS Name: carbonic acid [3-[[(3E,5E)-1-hydroxy-1-[3-(trifluoromethyl)phenyl]hexadeca-3,5-dien-2-yl]thio]-4-oxo-1-benzopyran-2-yl] methyl ester IUPAC Name: [3-[(3E,5E)-1-hydroxy-1-[3-(trifluoromethyl)phenyl]hexadeca-3,5-dien-2-yl]sulfanyl-4-oxochromen-2-yl] methyl carbonate Traditional Name: carbonic acid [3-[[(2E,4E)-1-[hydroxy-[3-(trifluoromethyl)phenyl]methyl]pentadeca-2,4-dienyl]thio]-4-keto-chromen-2-yl] methyl ester Formula: C34H39F3O6S MolecularWeight: 632.73007

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=CC=CC(C(C1=CC(=CC=C1)C(F)(F)F)O)SC2=C(OC3=CC=CC=C3C2=O)OC(=O)OC

Isomeric SMILES

CCCCCCCCCC/C=C/C=C/C(C(C1=CC(=CC=C1)C(F)(F)F)O)SC2=C(OC3=CC=CC=C3C2=O)OC(=O)OC

InChI

InChI=1S/C34H39F3O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-22-28(29(38)24-18-17-19-25(23-24)34(35,36)37)44-31-30(39)26-20-15-16-21-27(26)42-32(31)43-33(40)41-2/h12-23,28-29,38H,3-11H2,1-2H3/b13-12+,22-14+