2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxidanylidene-ethyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxidanylidene-ethyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxo-ethyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(2,6-dimethyl-4-morpholinyl)-2-oxoethyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[2-(2,6-dimethylmorpholino)-2-keto-ethyl]-4-nitro-isoindoline-1,3-quinone Formula: C16H17N3O6 MolecularWeight: 347.32268

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CC(O1)C)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O6/c1-9-6-17(7-10(2)25-9)13(20)8-18-15(21)11-4-3-5-12(19(23)24)14(11)16(18)22/h3-5,9-10H,6-8H2,1-2H3