(6-bromanyl-1,3-benzodioxol-5-yl)methyl 5-methylpyrazine-2-carboxylate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 5-methylpyrazine-2-carboxylate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C14H11BrN2O4 MolecularWeight: 351.15214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)OCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)OCC2=CC3=C(C=C2Br)OCO3

InChI

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