[2-(4-tert-butylphenyl)-4-oxidanylidene-chromen-3-yl] 3-bromanylbenzoate

Systemtic Name: [2-(4-tert-butylphenyl)-4-oxidanylidene-chromen-3-yl] 3-bromanylbenzoate Openeye Name: [2-(4-tert-butylphenyl)-4-oxo-chromen-3-yl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-(4-tert-butylphenyl)-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-tert-butylphenyl)-4-oxochromen-3-yl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-(4-tert-butylphenyl)-4-keto-chromen-3-yl] ester Formula: C26H21BrO4 MolecularWeight: 477.34654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C26H21BrO4/c1-26(2,3)18-13-11-16(12-14-18)23-24(22(28)20-9-4-5-10-21(20)30-23)31-25(29)17-7-6-8-19(27)15-17/h4-15H,1-3H3