2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-5-nitro-isoindole-1,3-dione Openeye Name: 2-(2-morpholino-2-oxo-ethyl)-5-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(4-morpholinyl)-2-oxoethyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-(2-morpholin-4-yl-2-oxoethyl)-5-nitroisoindole-1,3-dione Traditional Name: 2-(2-keto-2-morpholino-ethyl)-5-nitro-isoindoline-1,3-quinone Formula: C14H13N3O6 MolecularWeight: 319.26952

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O6/c18-12(15-3-5-23-6-4-15)8-16-13(19)10-2-1-9(17(21)22)7-11(10)14(16)20/h1-2,7H,3-6,8H2