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

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 3-azanylpyrazine-2-carboxylate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 3-aminopyrazine-2-carboxylate CAS Name: 3-amino-2-pyrazinecarboxylic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 3-aminopyrazine-2-carboxylate Traditional Name: 3-aminopyrazinic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C13H10BrN3O4 MolecularWeight: 352.1402

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=NC=CN=C3N)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=NC=CN=C3N)Br

InChI

InChI=1S/C13H10BrN3O4/c14-8-4-10-9(20-6-21-10)3-7(8)5-19-13(18)11-12(15)17-2-1-16-11/h1-4H,5-6H2,(H2,15,17)