5-chloranyl-2-(1H-pyrazol-5-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 5-chloranyl-2-(1H-pyrazol-5-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 5-chloro-2-(1H-pyrazol-5-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 5-chloro-2-(1H-pyrazol-5-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 5-chloro-2-(1H-pyrazol-5-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 5-chloro-2-(1H-pyrazol-5-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C11H10ClN3O2 MolecularWeight: 251.669

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CC2C1C(=O)N(C2=O)C3=CC=NN3)Cl

Isomeric SMILES

C1C=C(CC2C1C(=O)N(C2=O)C3=CC=NN3)Cl

InChI

InChI=1S/C11H10ClN3O2/c12-6-1-2-7-8(5-6)11(17)15(10(7)16)9-3-4-13-14-9/h1,3-4,7-8H,2,5H2,(H,13,14)