2-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-3-oxidanylidene-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-3-oxidanylidene-propyl]isoindole-1,3-dione Openeye Name: 2-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-3-oxo-propyl]isoindoline-1,3-dione CAS Name: 2-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)-3-oxopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)-3-oxopropyl]isoindole-1,3-dione Traditional Name: 2-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-3-keto-propyl]isoindoline-1,3-quinone Formula: C16H14BrN3O3 MolecularWeight: 376.20466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)CCN2C(=O)C3=CC=CC=C3C2=O)C)Br

Isomeric SMILES

CC1=C(C(=NN1C(=O)CCN2C(=O)C3=CC=CC=C3C2=O)C)Br

InChI

InChI=1S/C16H14BrN3O3/c1-9-14(17)10(2)20(18-9)13(21)7-8-19-15(22)11-5-3-4-6-12(11)16(19)23/h3-6H,7-8H2,1-2H3