1-(4-bromanyl-2-methyl-pyrazol-3-yl)pyrrole-2,5-dione

Systemtic Name: 1-(4-bromanyl-2-methyl-pyrazol-3-yl)pyrrole-2,5-dione Openeye Name: 1-(4-bromo-2-methyl-pyrazol-3-yl)pyrrole-2,5-dione CAS Name: 1-(4-bromo-2-methyl-3-pyrazolyl)pyrrole-2,5-dione IUPAC Name: 1-(4-bromo-2-methylpyrazol-3-yl)pyrrole-2,5-dione Traditional Name: 1-(4-bromo-2-methyl-pyrazol-3-yl)-3-pyrroline-2,5-quinone Formula: C8H6BrN3O2 MolecularWeight: 256.05614

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)N2C(=O)C=CC2=O

Isomeric SMILES

CN1C(=C(C=N1)Br)N2C(=O)C=CC2=O

InChI

InChI=1S/C8H6BrN3O2/c1-11-8(5(9)4-10-11)12-6(13)2-3-7(12)14/h2-4H,1H3