5-bromanyl-2-(3,5-dimethyl-1H-pyrazol-4-yl)isoindole-1,3-dione

Systemtic Name: 5-bromanyl-2-(3,5-dimethyl-1H-pyrazol-4-yl)isoindole-1,3-dione Openeye Name: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-4-yl)isoindoline-1,3-dione CAS Name: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-4-yl)isoindole-1,3-dione IUPAC Name: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-4-yl)isoindole-1,3-dione Traditional Name: 5-bromo-2-(3,5-dimethyl-1H-pyrazol-4-yl)isoindoline-1,3-quinone Formula: C13H10BrN3O2 MolecularWeight: 320.1414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)N2C(=O)C3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=NN1)C)N2C(=O)C3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C13H10BrN3O2/c1-6-11(7(2)16-15-6)17-12(18)9-4-3-8(14)5-10(9)13(17)19/h3-5H,1-2H3,(H,15,16)