5-chloranyl-4-pyrimidin-2-yl-isoindole-1,3-dione

Systemtic Name: 5-chloranyl-4-pyrimidin-2-yl-isoindole-1,3-dione Openeye Name: 5-chloro-4-pyrimidin-2-yl-isoindoline-1,3-dione CAS Name: 5-chloro-4-(2-pyrimidinyl)isoindole-1,3-dione IUPAC Name: 5-chloro-4-pyrimidin-2-ylisoindole-1,3-dione Traditional Name: 5-chloro-4-(2-pyrimidyl)isoindoline-1,3-quinone Formula: C12H6ClN3O2 MolecularWeight: 259.64794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)C2=C(C=CC3=C2C(=O)NC3=O)Cl

Isomeric SMILES

C1=CN=C(N=C1)C2=C(C=CC3=C2C(=O)NC3=O)Cl

InChI

InChI=1S/C12H6ClN3O2/c13-7-3-2-6-8(12(18)16-11(6)17)9(7)10-14-4-1-5-15-10/h1-5H,(H,16,17,18)