5-[(E)-2-(5-bromanyl-2-phenylmethoxy-phenyl)ethenyl]pyrazine-2-carboxylic acid

Systemtic Name: 5-[(E)-2-(5-bromanyl-2-phenylmethoxy-phenyl)ethenyl]pyrazine-2-carboxylic acid Openeye Name: 5-[(E)-2-(2-benzyloxy-5-bromo-phenyl)vinyl]pyrazine-2-carboxylic acid CAS Name: 5-[(E)-2-(5-bromo-2-phenylmethoxyphenyl)ethenyl]-2-pyrazinecarboxylic acid IUPAC Name: 5-[(E)-2-(5-bromo-2-phenylmethoxyphenyl)ethenyl]pyrazine-2-carboxylic acid Traditional Name: 5-[(E)-2-(2-benzoxy-5-bromo-phenyl)vinyl]pyrazinoic acid Formula: C20H15BrN2O3 MolecularWeight: 411.2487

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C=CC3=CN=C(C=N3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)/C=C/C3=CN=C(C=N3)C(=O)O

InChI

InChI=1S/C20H15BrN2O3/c21-16-7-9-19(26-13-14-4-2-1-3-5-14)15(10-16)6-8-17-11-23-18(12-22-17)20(24)25/h1-12H,13H2,(H,24,25)/b8-6+