(3-cyanophenyl)methyl 2-bromanyl-5-methoxy-benzoate

Systemtic Name: (3-cyanophenyl)methyl 2-bromanyl-5-methoxy-benzoate Openeye Name: (3-cyanophenyl)methyl 2-bromo-5-methoxy-benzoate CAS Name: 2-bromo-5-methoxybenzoic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 2-bromo-5-methoxybenzoate Traditional Name: 2-bromo-5-methoxy-benzoic acid (3-cyanobenzyl) ester Formula: C16H12BrNO3 MolecularWeight: 346.17538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)OCC2=CC=CC(=C2)C#N

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)OCC2=CC=CC(=C2)C#N

InChI

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