[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate Openeye Name: [2-(3-bromo-4-methoxy-phenyl)-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-(3-bromo-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C14H11BrN2O4 MolecularWeight: 351.15214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)COC(=O)C2=NC=CN=C2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)COC(=O)C2=NC=CN=C2)Br

InChI

InChI=1S/C14H11BrN2O4/c1-20-13-3-2-9(6-10(13)15)12(18)8-21-14(19)11-7-16-4-5-17-11/h2-7H,8H2,1H3