2-(2-bromanyl-7-methyl-3-phenyl-1-benzofuran-5-yl)ethanenitrile

Systemtic Name: 2-(2-bromanyl-7-methyl-3-phenyl-1-benzofuran-5-yl)ethanenitrile Openeye Name: 2-(2-bromo-7-methyl-3-phenyl-benzofuran-5-yl)acetonitrile CAS Name: 2-(2-bromo-7-methyl-3-phenyl-5-benzofuranyl)acetonitrile IUPAC Name: 2-(2-bromo-7-methyl-3-phenyl-1-benzofuran-5-yl)acetonitrile Traditional Name: 2-(2-bromo-7-methyl-3-phenyl-benzofuran-5-yl)acetonitrile Formula: C17H12BrNO MolecularWeight: 326.18728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)CC#N)C(=C(O2)Br)C3=CC=CC=C3

Isomeric SMILES

CC1=C2C(=CC(=C1)CC#N)C(=C(O2)Br)C3=CC=CC=C3

InChI

InChI=1S/C17H12BrNO/c1-11-9-12(7-8-19)10-14-15(17(18)20-16(11)14)13-5-3-2-4-6-13/h2-6,9-10H,7H2,1H3