2-[4-(4-nitrophenyl)sulfanylphenyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(4-nitrophenyl)sulfanylphenyl]isoindole-1,3-dione Openeye Name: 2-[4-(4-nitrophenyl)sulfanylphenyl]isoindoline-1,3-dione CAS Name: 2-[4-[(4-nitrophenyl)thio]phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-(4-nitrophenyl)sulfanylphenyl]isoindole-1,3-dione Traditional Name: 2-[4-[(4-nitrophenyl)thio]phenyl]isoindoline-1,3-quinone Formula: C20H12N2O4S MolecularWeight: 376.38528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)SC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)SC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H12N2O4S/c23-19-17-3-1-2-4-18(17)20(24)21(19)13-5-9-15(10-6-13)27-16-11-7-14(8-12-16)22(25)26/h1-12H