2-[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(4-bromanylphenoxy)-2-oxidanyl-propyl]isoindole-1,3-dione Openeye Name: 2-[3-(4-bromophenoxy)-2-hydroxy-propyl]isoindoline-1,3-dione CAS Name: 2-[3-(4-bromophenoxy)-2-hydroxypropyl]isoindole-1,3-dione IUPAC Name: 2-[3-(4-bromophenoxy)-2-hydroxypropyl]isoindole-1,3-dione Traditional Name: 2-[3-(4-bromophenoxy)-2-hydroxy-propyl]isoindoline-1,3-quinone Formula: C17H14BrNO4 MolecularWeight: 376.20136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(COC3=CC=C(C=C3)Br)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(COC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C17H14BrNO4/c18-11-5-7-13(8-6-11)23-10-12(20)9-19-16(21)14-3-1-2-4-15(14)17(19)22/h1-8,12,20H,9-10H2