(4-oxidanylidene-3-phenyl-chromen-7-yl) 2-bromanyl-3,4,5-trimethoxy-benzoate

Systemtic Name: (4-oxidanylidene-3-phenyl-chromen-7-yl) 2-bromanyl-3,4,5-trimethoxy-benzoate Openeye Name: (4-oxo-3-phenyl-chromen-7-yl) 2-bromo-3,4,5-trimethoxy-benzoate CAS Name: 2-bromo-3,4,5-trimethoxybenzoic acid (4-oxo-3-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (4-oxo-3-phenylchromen-7-yl) 2-bromo-3,4,5-trimethoxybenzoate Traditional Name: 2-bromo-3,4,5-trimethoxy-benzoic acid (4-keto-3-phenyl-chromen-7-yl) ester Formula: C25H19BrO7 MolecularWeight: 511.31816

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4)Br)OC)OC

InChI

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