(2-cyanophenyl)methyl 3-bromanyl-4-methoxy-benzoate

Systemtic Name: (2-cyanophenyl)methyl 3-bromanyl-4-methoxy-benzoate Openeye Name: (2-cyanophenyl)methyl 3-bromo-4-methoxy-benzoate CAS Name: 3-bromo-4-methoxybenzoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 3-bromo-4-methoxybenzoate Traditional Name: 3-bromo-4-methoxy-benzoic acid (2-cyanobenzyl) ester Formula: C16H12BrNO3 MolecularWeight: 346.17538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2C#N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2C#N)Br

InChI

InChI=1S/C16H12BrNO3/c1-20-15-7-6-11(8-14(15)17)16(19)21-10-13-5-3-2-4-12(13)9-18/h2-8H,10H2,1H3