2-(4-bromanylphenoxy)ethyl 3-cyanobenzoate

Systemtic Name: 2-(4-bromanylphenoxy)ethyl 3-cyanobenzoate Openeye Name: 2-(4-bromophenoxy)ethyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid 2-(4-bromophenoxy)ethyl ester IUPAC Name: 2-(4-bromophenoxy)ethyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid 2-(4-bromophenoxy)ethyl ester Formula: C16H12BrNO3 MolecularWeight: 346.17538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OCCOC2=CC=C(C=C2)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)OCCOC2=CC=C(C=C2)Br)C#N

InChI

InChI=1S/C16H12BrNO3/c17-14-4-6-15(7-5-14)20-8-9-21-16(19)13-3-1-2-12(10-13)11-18/h1-7,10H,8-9H2