[2-(3-bromanyl-4,5-dimethoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 3,4,5-trimethoxybenzoate

Systemtic Name: [2-(3-bromanyl-4,5-dimethoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 3,4,5-trimethoxybenzoate Openeye Name: [2-(3-bromo-4,5-dimethoxy-phenyl)-4-oxo-chromen-3-yl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [2-(3-bromo-4,5-dimethoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3-bromo-4,5-dimethoxyphenyl)-4-oxochromen-3-yl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [2-(3-bromo-4,5-dimethoxy-phenyl)-4-keto-chromen-3-yl] ester Formula: C27H23BrO9 MolecularWeight: 571.37012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=C(OC3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)Br)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=C(OC3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)Br)OC)OC

InChI

InChI=1S/C27H23BrO9/c1-31-19-11-14(10-17(28)24(19)34-4)23-26(22(29)16-8-6-7-9-18(16)36-23)37-27(30)15-12-20(32-2)25(35-5)21(13-15)33-3/h6-13H,1-5H3