[8-(hydroxymethyl)-1-oxidanylidene-4-pent-4-enyl-dibenzothiophen-4-yl] prop-2-enyl carbonate

Systemtic Name: [8-(hydroxymethyl)-1-oxidanylidene-4-pent-4-enyl-dibenzothiophen-4-yl] prop-2-enyl carbonate Openeye Name: allyl [8-(hydroxymethyl)-1-oxo-4-pent-4-enyl-dibenzothiophen-4-yl] carbonate CAS Name: carbonic acid [8-(hydroxymethyl)-1-oxo-4-pent-4-enyl-4-dibenzothiophenyl] prop-2-enyl ester IUPAC Name: [8-(hydroxymethyl)-1-oxo-4-pent-4-enyldibenzothiophen-4-yl] prop-2-enyl carbonate Traditional Name: carbonic acid allyl (1-keto-8-methylol-4-pent-4-enyl-dibenzothiophen-4-yl) ester Formula: C22H22O5S MolecularWeight: 398.47208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCCCC1(C=CC(=O)C2=C1SC3=C2C=C(C=C3)CO)OC(=O)OCC=C

Isomeric SMILES

C=CCCCC1(C=CC(=O)C2=C1SC3=C2C=C(C=C3)CO)OC(=O)OCC=C

InChI

InChI=1S/C22H22O5S/c1-3-5-6-10-22(27-21(25)26-12-4-2)11-9-17(24)19-16-13-15(14-23)7-8-18(16)28-20(19)22/h3-4,7-9,11,13,23H,1-2,5-6,10,12,14H2