4-[2-(5-bromanyl-2-methoxy-phenyl)-1-cyano-ethenyl]benzoic acid

Systemtic Name: 4-[2-(5-bromanyl-2-methoxy-phenyl)-1-cyano-ethenyl]benzoic acid Openeye Name: 4-[2-(5-bromo-2-methoxy-phenyl)-1-cyano-vinyl]benzoic acid CAS Name: 4-[2-(5-bromo-2-methoxyphenyl)-1-cyanoethenyl]benzoic acid IUPAC Name: 4-[2-(5-bromo-2-methoxyphenyl)-1-cyanoethenyl]benzoic acid Traditional Name: 4-[2-(5-bromo-2-methoxy-phenyl)-1-cyano-vinyl]benzoic acid Formula: C17H12BrNO3 MolecularWeight: 358.18608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrNO3/c1-22-16-7-6-15(18)9-13(16)8-14(10-19)11-2-4-12(5-3-11)17(20)21/h2-9H,1H3,(H,20,21)