2-(3-nitrophenyl)sulfanylisoindole-1,3-dione

Systemtic Name: 2-(3-nitrophenyl)sulfanylisoindole-1,3-dione Openeye Name: 2-(3-nitrophenyl)sulfanylisoindoline-1,3-dione CAS Name: 2-[(3-nitrophenyl)thio]isoindole-1,3-dione IUPAC Name: 2-(3-nitrophenyl)sulfanylisoindole-1,3-dione Traditional Name: 2-[(3-nitrophenyl)thio]isoindoline-1,3-quinone Formula: C14H8N2O4S MolecularWeight: 300.28932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)SC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)SC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H8N2O4S/c17-13-11-6-1-2-7-12(11)14(18)15(13)21-10-5-3-4-9(8-10)16(19)20/h1-8H