[4-oxidanylidene-2-(3,4,5-trimethoxyphenyl)chromen-6-yl] 3-bromanylbenzoate

Systemtic Name: [4-oxidanylidene-2-(3,4,5-trimethoxyphenyl)chromen-6-yl] 3-bromanylbenzoate Openeye Name: [4-oxo-2-(3,4,5-trimethoxyphenyl)chromen-6-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-oxo-2-(3,4,5-trimethoxyphenyl)-1-benzopyran-6-yl] ester IUPAC Name: [4-oxo-2-(3,4,5-trimethoxyphenyl)chromen-6-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-keto-2-(3,4,5-trimethoxyphenyl)chromen-6-yl] ester Formula: C25H19BrO7 MolecularWeight: 511.31816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CC(=O)C3=C(O2)C=CC(=C3)OC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CC(=O)C3=C(O2)C=CC(=C3)OC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C25H19BrO7/c1-29-22-10-15(11-23(30-2)24(22)31-3)21-13-19(27)18-12-17(7-8-20(18)33-21)32-25(28)14-5-4-6-16(26)9-14/h4-13H,1-3H3