4-[(4-bromanyl-2-ethanoyl-phenoxy)methyl]benzenecarbonitrile

Systemtic Name: 4-[(4-bromanyl-2-ethanoyl-phenoxy)methyl]benzenecarbonitrile Openeye Name: 4-[(2-acetyl-4-bromo-phenoxy)methyl]benzonitrile CAS Name: 4-[(2-acetyl-4-bromophenoxy)methyl]benzonitrile IUPAC Name: 4-[(2-acetyl-4-bromophenoxy)methyl]benzonitrile Traditional Name: 4-[(2-acetyl-4-bromo-phenoxy)methyl]benzonitrile Formula: C16H12BrNO2 MolecularWeight: 330.17598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H12BrNO2/c1-11(19)15-8-14(17)6-7-16(15)20-10-13-4-2-12(9-18)3-5-13/h2-8H,10H2,1H3