2-(hydroxymethyl)-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-(hydroxymethyl)-5-nitro-isoindole-1,3-dione Openeye Name: 2-(hydroxymethyl)-5-nitro-isoindoline-1,3-dione CAS Name: 2-(hydroxymethyl)-5-nitroisoindole-1,3-dione IUPAC Name: 2-(hydroxymethyl)-5-nitroisoindole-1,3-dione Traditional Name: 2-methylol-5-nitro-isoindoline-1,3-quinone Formula: C9H6N2O5 MolecularWeight: 222.15434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CO

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)N(C2=O)CO

InChI

InChI=1S/C9H6N2O5/c12-4-10-8(13)6-2-1-5(11(15)16)3-7(6)9(10)14/h1-3,12H,4H2