[3-[(E)-6-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)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)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-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)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)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-methyl-pent-2-enyl]-4-keto-7-thioxo-6H-chromen-2-yl] methyl ester Formula: C28H30O8S MolecularWeight: 526.598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCC=CC(C)C2=C(OC3=CC(=S)CC=C3C2=O)OC(=O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC/C=C/C(C)C2=C(OC3=CC(=S)CC=C3C2=O)OC(=O)OC

InChI

InChI=1S/C28H30O8S/c1-5-8-20-22(13-12-19(17(3)29)25(20)30)34-14-7-6-9-16(2)24-26(31)21-11-10-18(37)15-23(21)35-27(24)36-28(32)33-4/h6,9,11-13,15-16,30H,5,7-8,10,14H2,1-4H3/b9-6+