3-(3-bromophenyl)-5,7-ditert-butyl-3H-1-benzofuran-2-one

Systemtic Name: 3-(3-bromophenyl)-5,7-ditert-butyl-3H-1-benzofuran-2-one Openeye Name: 3-(3-bromophenyl)-5,7-ditert-butyl-3H-benzofuran-2-one CAS Name: 3-(3-bromophenyl)-5,7-ditert-butyl-3H-benzofuran-2-one IUPAC Name: 3-(3-bromophenyl)-5,7-ditert-butyl-3H-1-benzofuran-2-one Traditional Name: 3-(3-bromophenyl)-5,7-ditert-butyl-coumaran-2-one Formula: C22H25BrO2 MolecularWeight: 401.3367

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)C(C(=O)O2)C3=CC(=CC=C3)Br)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)C(C(=O)O2)C3=CC(=CC=C3)Br)C(C)(C)C

InChI

InChI=1S/C22H25BrO2/c1-21(2,3)14-11-16-18(13-8-7-9-15(23)10-13)20(24)25-19(16)17(12-14)22(4,5)6/h7-12,18H,1-6H3