2-[4-[(E)-3-(5-bromanyl-1-benzofuran-2-yl)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-3-(5-bromanyl-1-benzofuran-2-yl)-3-oxidanylidene-prop-1-enyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-(5-bromobenzofuran-2-yl)-3-oxo-prop-1-enyl]phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-(5-bromo-2-benzofuranyl)-3-oxoprop-1-enyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-(5-bromo-1-benzofuran-2-yl)-3-oxoprop-1-enyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-(5-bromobenzofuran-2-yl)-3-keto-prop-1-enyl]phenoxy]acetonitrile Formula: C19H12BrNO3 MolecularWeight: 382.20748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=CC3=C(O2)C=CC(=C3)Br)OCC#N

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)C2=CC3=C(O2)C=CC(=C3)Br)OCC#N

InChI

InChI=1S/C19H12BrNO3/c20-15-4-8-18-14(11-15)12-19(24-18)17(22)7-3-13-1-5-16(6-2-13)23-10-9-21/h1-8,11-12H,10H2/b7-3+