methyl 4-[bis(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]benzoate

Systemtic Name: methyl 4-[bis(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]benzoate Openeye Name: methyl 4-[bis(2-hydroxy-4-oxo-chromen-3-yl)methyl]benzoate CAS Name: 4-[bis(2-hydroxy-4-oxo-1-benzopyran-3-yl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[bis(2-hydroxy-4-oxochromen-3-yl)methyl]benzoate Traditional Name: 4-[bis(2-hydroxy-4-keto-chromen-3-yl)methyl]benzoic acid methyl ester Formula: C27H18O8 MolecularWeight: 470.42702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(C2=C(OC3=CC=CC=C3C2=O)O)C4=C(OC5=CC=CC=C5C4=O)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(C2=C(OC3=CC=CC=C3C2=O)O)C4=C(OC5=CC=CC=C5C4=O)O

InChI

InChI=1S/C27H18O8/c1-33-25(30)15-12-10-14(11-13-15)20(21-23(28)16-6-2-4-8-18(16)34-26(21)31)22-24(29)17-7-3-5-9-19(17)35-27(22)32/h2-13,20,31-32H,1H3