[5-(6-acetyloxy-7-methoxy-5-oxidanyl-4-oxidanylidene-chromen-3-yl)-2-methoxy-phenyl] ethanoate

Systemtic Name: [5-(6-acetyloxy-7-methoxy-5-oxidanyl-4-oxidanylidene-chromen-3-yl)-2-methoxy-phenyl] ethanoate Openeye Name: [5-(6-acetoxy-5-hydroxy-7-methoxy-4-oxo-chromen-3-yl)-2-methoxy-phenyl] acetate CAS Name: acetic acid [5-(6-acetyloxy-5-hydroxy-7-methoxy-4-oxo-1-benzopyran-3-yl)-2-methoxyphenyl] ester IUPAC Name: [5-(6-acetyloxy-5-hydroxy-7-methoxy-4-oxochromen-3-yl)-2-methoxyphenyl] acetate Traditional Name: acetic acid [5-(6-acetoxy-5-hydroxy-4-keto-7-methoxy-chromen-3-yl)-2-methoxy-phenyl] ester Formula: C21H18O9 MolecularWeight: 414.36222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC(=C1)C2=COC3=CC(=C(C(=C3C2=O)O)OC(=O)C)OC)OC

Isomeric SMILES

CC(=O)OC1=C(C=CC(=C1)C2=COC3=CC(=C(C(=C3C2=O)O)OC(=O)C)OC)OC

InChI

InChI=1S/C21H18O9/c1-10(22)29-15-7-12(5-6-14(15)26-3)13-9-28-16-8-17(27-4)21(30-11(2)23)20(25)18(16)19(13)24/h5-9,25H,1-4H3