5-bromanyl-2-(pyridin-4-ylamino)isoindole-1,3-dione hydrochloride

Systemtic Name: 5-bromanyl-2-(pyridin-4-ylamino)isoindole-1,3-dione hydrochloride Openeye Name: 5-bromo-2-(4-pyridylamino)isoindoline-1,3-dione hydrochloride CAS Name: 5-bromo-2-(pyridin-4-ylamino)isoindole-1,3-dione hydrochloride IUPAC Name: 5-bromo-2-(pyridin-4-ylamino)isoindole-1,3-dione hydrochloride Traditional Name: 5-bromo-2-(4-pyridylamino)isoindoline-1,3-quinone hydrochloride Formula: C13H9BrClN3O2 MolecularWeight: 354.58646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=O)N(C2=O)NC3=CC=NC=C3.Cl

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=O)N(C2=O)NC3=CC=NC=C3.Cl

InChI

InChI=1S/C13H8BrN3O2.ClH/c14-8-1-2-10-11(7-8)13(19)17(12(10)18)16-9-3-5-15-6-4-9;/h1-7H,(H,15,16);1H