(2-bromanyl-4-methyl-phenyl) 3-cyanobenzoate

Systemtic Name: (2-bromanyl-4-methyl-phenyl) 3-cyanobenzoate Openeye Name: (2-bromo-4-methyl-phenyl) 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (2-bromo-4-methylphenyl) ester IUPAC Name: (2-bromo-4-methylphenyl) 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid (2-bromo-4-methyl-phenyl) ester Formula: C15H10BrNO2 MolecularWeight: 316.1494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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