(6'-acetyloxy-3-oxidanylidene-5-sulfanyl-spiro[2-benzofuran-1,9'-xanthene]-3'-yl) ethanoate

Systemtic Name: (6'-acetyloxy-3-oxidanylidene-5-sulfanyl-spiro[2-benzofuran-1,9'-xanthene]-3'-yl) ethanoate Openeye Name: (6'-acetoxy-3-oxo-5-sulfanyl-spiro[isobenzofuran-1,9'-xanthene]-3'-yl) acetate CAS Name: acetic acid (6'-acetyloxy-5-mercapto-3-oxo-3'-spiro[isobenzofuran-1,9'-xanthene]yl) ester IUPAC Name: (6'-acetyloxy-3-oxo-5-sulfanylspiro[2-benzofuran-1,9'-xanthene]-3'-yl) acetate Traditional Name: acetic acid (6'-acetoxy-3-keto-5-mercapto-spiro[phthalan-1,9'-xanthene]-3'-yl) ester Formula: C24H16O7S MolecularWeight: 448.44464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)S)C(=O)O3)C5=C(O2)C=C(C=C5)OC(=O)C

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1)C3(C4=C(C=C(C=C4)S)C(=O)O3)C5=C(O2)C=C(C=C5)OC(=O)C

InChI

InChI=1S/C24H16O7S/c1-12(25)28-14-3-6-19-21(9-14)30-22-10-15(29-13(2)26)4-7-20(22)24(19)18-8-5-16(32)11-17(18)23(27)31-24/h3-11,32H,1-2H3