[2-(4-tert-butylphenyl)-6-methyl-4-oxidanylidene-chromen-3-yl] 5-bromanylfuran-2-carboxylate

Systemtic Name: [2-(4-tert-butylphenyl)-6-methyl-4-oxidanylidene-chromen-3-yl] 5-bromanylfuran-2-carboxylate Openeye Name: [2-(4-tert-butylphenyl)-6-methyl-4-oxo-chromen-3-yl] 5-bromofuran-2-carboxylate CAS Name: 5-bromo-2-furancarboxylic acid [2-(4-tert-butylphenyl)-6-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-tert-butylphenyl)-6-methyl-4-oxochromen-3-yl] 5-bromofuran-2-carboxylate Traditional Name: 5-bromofuran-2-carboxylic acid [2-(4-tert-butylphenyl)-4-keto-6-methyl-chromen-3-yl] ester Formula: C25H21BrO5 MolecularWeight: 481.33524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC=C(O3)Br)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC=C(O3)Br)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C25H21BrO5/c1-14-5-10-18-17(13-14)21(27)23(31-24(28)19-11-12-20(26)29-19)22(30-18)15-6-8-16(9-7-15)25(2,3)4/h5-13H,1-4H3