(2-bromanyl-4-methyl-phenyl) 4-cyanobenzoate

Systemtic Name: (2-bromanyl-4-methyl-phenyl) 4-cyanobenzoate Openeye Name: (2-bromo-4-methyl-phenyl) 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid (2-bromo-4-methylphenyl) ester IUPAC Name: (2-bromo-4-methylphenyl) 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (2-bromo-4-methyl-phenyl) ester Formula: C15H10BrNO2 MolecularWeight: 316.1494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C#N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C#N)Br

InChI

InChI=1S/C15H10BrNO2/c1-10-2-7-14(13(16)8-10)19-15(18)12-5-3-11(9-17)4-6-12/h2-8H,1H3