2-[4-bromanyl-2-(4-hydroxyphenyl)-5-oxidanyl-1-benzofuran-7-yl]ethanenitrile

Systemtic Name: 2-[4-bromanyl-2-(4-hydroxyphenyl)-5-oxidanyl-1-benzofuran-7-yl]ethanenitrile Openeye Name: 2-[4-bromo-5-hydroxy-2-(4-hydroxyphenyl)benzofuran-7-yl]acetonitrile CAS Name: 2-[4-bromo-5-hydroxy-2-(4-hydroxyphenyl)-7-benzofuranyl]acetonitrile IUPAC Name: 2-[4-bromo-5-hydroxy-2-(4-hydroxyphenyl)-1-benzofuran-7-yl]acetonitrile Traditional Name: 2-[4-bromo-5-hydroxy-2-(4-hydroxyphenyl)benzofuran-7-yl]acetonitrile Formula: C16H10BrNO3 MolecularWeight: 344.1595

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC3=C(O2)C(=CC(=C3Br)O)CC#N)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC3=C(O2)C(=CC(=C3Br)O)CC#N)O

InChI

InChI=1S/C16H10BrNO3/c17-15-12-8-14(9-1-3-11(19)4-2-9)21-16(12)10(5-6-18)7-13(15)20/h1-4,7-8,19-20H,5H2