2-(2-ethanoylthiophen-3-yl)-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-(2-ethanoylthiophen-3-yl)-4-nitro-isoindole-1,3-dione Openeye Name: 2-(2-acetyl-3-thienyl)-4-nitro-isoindoline-1,3-dione CAS Name: 2-(2-acetyl-3-thiophenyl)-4-nitroisoindole-1,3-dione IUPAC Name: 2-(2-acetylthiophen-3-yl)-4-nitroisoindole-1,3-dione Traditional Name: 2-(2-acetyl-3-thienyl)-4-nitro-isoindoline-1,3-quinone Formula: C14H8N2O5S MolecularWeight: 316.28872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CS1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=C(C=CS1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H8N2O5S/c1-7(17)12-10(5-6-22-12)15-13(18)8-3-2-4-9(16(20)21)11(8)14(15)19/h2-6H,1H3