[8-acetyloxy-4-(dodecylsulfanylmethyl)-2-oxidanylidene-chromen-7-yl] ethanoate

Systemtic Name: [8-acetyloxy-4-(dodecylsulfanylmethyl)-2-oxidanylidene-chromen-7-yl] ethanoate Openeye Name: [8-acetoxy-4-(dodecylsulfanylmethyl)-2-oxo-chromen-7-yl] acetate CAS Name: acetic acid [8-acetyloxy-4-[(dodecylthio)methyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [8-acetyloxy-4-(dodecylsulfanylmethyl)-2-oxochromen-7-yl] acetate Traditional Name: acetic acid [8-acetoxy-2-keto-4-[(laurylthio)methyl]chromen-7-yl] ester Formula: C26H36O6S MolecularWeight: 476.62544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCC1=CC(=O)OC2=C1C=CC(=C2OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCSCC1=CC(=O)OC2=C1C=CC(=C2OC(=O)C)OC(=O)C

InChI

InChI=1S/C26H36O6S/c1-4-5-6-7-8-9-10-11-12-13-16-33-18-21-17-24(29)32-25-22(21)14-15-23(30-19(2)27)26(25)31-20(3)28/h14-15,17H,4-13,16,18H2,1-3H3