[2-(3-bromanyl-4-methoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 3,4-dimethoxybenzoate

Systemtic Name: [2-(3-bromanyl-4-methoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 3,4-dimethoxybenzoate Openeye Name: [2-(3-bromo-4-methoxy-phenyl)-4-oxo-chromen-3-yl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [2-(3-bromo-4-methoxyphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(3-bromo-4-methoxyphenyl)-4-oxochromen-3-yl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [2-(3-bromo-4-methoxy-phenyl)-4-keto-chromen-3-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=C(OC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)OC)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=C(OC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)OC)Br)OC

InChI

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