5-nitro-2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)isoindole-1,3-dione

Systemtic Name: 5-nitro-2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)isoindole-1,3-dione Openeye Name: 5-nitro-2-[2-oxo-2-(2-thienyl)ethyl]isoindoline-1,3-dione CAS Name: 5-nitro-2-(2-oxo-2-thiophen-2-ylethyl)isoindole-1,3-dione IUPAC Name: 5-nitro-2-(2-oxo-2-thiophen-2-ylethyl)isoindole-1,3-dione Traditional Name: 2-[2-keto-2-(2-thienyl)ethyl]-5-nitro-isoindoline-1,3-quinone Formula: C14H8N2O5S MolecularWeight: 316.28872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H8N2O5S/c17-11(12-2-1-5-22-12)7-15-13(18)9-4-3-8(16(20)21)6-10(9)14(15)19/h1-6H,7H2