(3aS,7aR)-2-pyrimidin-2-yl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: (3aS,7aR)-2-pyrimidin-2-yl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: (3aS,7aR)-2-pyrimidin-2-yl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: (3aS,7aR)-2-(2-pyrimidinyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: (3aS,7aR)-2-pyrimidin-2-yl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: (3aS,7aR)-2-(2-pyrimidyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C12H11N3O2 MolecularWeight: 229.23464

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)C3=NC=CC=N3

Isomeric SMILES

C1C=CC[C@H]2[C@@H]1C(=O)N(C2=O)C3=NC=CC=N3

InChI

InChI=1S/C12H11N3O2/c16-10-8-4-1-2-5-9(8)11(17)15(10)12-13-6-3-7-14-12/h1-3,6-9H,4-5H2/t8-,9+