2-[2-(4-bromanylphenoxy)phenyl]-2-cyano-propanoic acid

Systemtic Name: 2-[2-(4-bromanylphenoxy)phenyl]-2-cyano-propanoic acid Openeye Name: 2-[2-(4-bromophenoxy)phenyl]-2-cyano-propanoic acid CAS Name: 2-[2-(4-bromophenoxy)phenyl]-2-cyanopropanoic acid IUPAC Name: 2-[2-(4-bromophenoxy)phenyl]-2-cyanopropanoic acid Traditional Name: 2-[2-(4-bromophenoxy)phenyl]-2-cyano-propionic acid Formula: C16H12BrNO3 MolecularWeight: 346.17538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1=CC=CC=C1OC2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

CC(C#N)(C1=CC=CC=C1OC2=CC=C(C=C2)Br)C(=O)O

InChI

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