4-(5-bromanyl-1-benzofuran-2-yl)-6-tert-butyl-chromen-2-one

Systemtic Name: 4-(5-bromanyl-1-benzofuran-2-yl)-6-tert-butyl-chromen-2-one Openeye Name: 4-(5-bromobenzofuran-2-yl)-6-tert-butyl-chromen-2-one CAS Name: 4-(5-bromo-2-benzofuranyl)-6-tert-butyl-1-benzopyran-2-one IUPAC Name: 4-(5-bromo-1-benzofuran-2-yl)-6-tert-butylchromen-2-one Traditional Name: 4-(5-bromobenzofuran-2-yl)-6-tert-butyl-coumarin Formula: C21H17BrO3 MolecularWeight: 397.26188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC(=O)C=C2C3=CC4=C(O3)C=CC(=C4)Br

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC(=O)C=C2C3=CC4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C21H17BrO3/c1-21(2,3)13-4-6-18-15(10-13)16(11-20(23)25-18)19-9-12-8-14(22)5-7-17(12)24-19/h4-11H,1-3H3