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

Systemtic Name: [2-(3-bromanyl-4,5-dimethoxy-phenyl)-4-oxidanylidene-chromen-3-yl] 3,4-dimethylbenzoate Openeye Name: [2-(3-bromo-4,5-dimethoxy-phenyl)-4-oxo-chromen-3-yl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic 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-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [2-(3-bromo-4,5-dimethoxy-phenyl)-4-keto-chromen-3-yl] ester Formula: C26H21BrO6 MolecularWeight: 509.34534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=C(OC3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)Br)OC)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=C(OC3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)Br)OC)OC)C

InChI

InChI=1S/C26H21BrO6/c1-14-9-10-16(11-15(14)2)26(29)33-25-22(28)18-7-5-6-8-20(18)32-23(25)17-12-19(27)24(31-4)21(13-17)30-3/h5-13H,1-4H3