3-bromanyl-3-(4-methoxy-3-methyl-phenyl)-2-benzofuran-1-one

Systemtic Name: 3-bromanyl-3-(4-methoxy-3-methyl-phenyl)-2-benzofuran-1-one Openeye Name: 3-bromo-3-(4-methoxy-3-methyl-phenyl)isobenzofuran-1-one CAS Name: 3-bromo-3-(4-methoxy-3-methylphenyl)-1-isobenzofuranone IUPAC Name: 3-bromo-3-(4-methoxy-3-methylphenyl)-2-benzofuran-1-one Traditional Name: 3-bromo-3-(4-methoxy-3-methyl-phenyl)phthalide Formula: C16H13BrO3 MolecularWeight: 333.17662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(C3=CC=CC=C3C(=O)O2)Br)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2(C3=CC=CC=C3C(=O)O2)Br)OC

InChI

InChI=1S/C16H13BrO3/c1-10-9-11(7-8-14(10)19-2)16(17)13-6-4-3-5-12(13)15(18)20-16/h3-9H,1-2H3