2-(2,3,4,5,6-pentadeuteriophenyl)sulfanylisoindole-1,3-dione

Systemtic Name: 2-(2,3,4,5,6-pentadeuteriophenyl)sulfanylisoindole-1,3-dione Openeye Name: 2-(2,3,4,5,6-pentadeuteriophenyl)sulfanylisoindoline-1,3-dione CAS Name: 2-[(2,3,4,5,6-pentadeuteriophenyl)thio]isoindole-1,3-dione IUPAC Name: 2-(2,3,4,5,6-pentadeuteriophenyl)sulfanylisoindole-1,3-dione Traditional Name: 2-[(2,3,4,5,6-pentadeuteriophenyl)thio]isoindoline-1,3-quinone Formula: C14H9NO2S MolecularWeight: 260.322569

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1[2H])[2H])SN2C(=O)C3=CC=CC=C3C2=O)[2H])[2H]

InChI

InChI=1S/C14H9NO2S/c16-13-11-8-4-5-9-12(11)14(17)15(13)18-10-6-2-1-3-7-10/h1-9H/i1D,2D,3D,6D,7D