2-(2,5-dimethylphenyl)-5-morpholin-4-yl-6-nitro-isoindole-1,3-dione

Systemtic Name: 2-(2,5-dimethylphenyl)-5-morpholin-4-yl-6-nitro-isoindole-1,3-dione Openeye Name: 2-(2,5-dimethylphenyl)-5-morpholino-6-nitro-isoindoline-1,3-dione CAS Name: 2-(2,5-dimethylphenyl)-5-(4-morpholinyl)-6-nitroisoindole-1,3-dione IUPAC Name: 2-(2,5-dimethylphenyl)-5-morpholin-4-yl-6-nitroisoindole-1,3-dione Traditional Name: 2-(2,5-dimethylphenyl)-5-morpholino-6-nitro-isoindoline-1,3-quinone Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC(=C(C=C3C2=O)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC(=C(C=C3C2=O)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C20H19N3O5/c1-12-3-4-13(2)16(9-12)22-19(24)14-10-17(21-5-7-28-8-6-21)18(23(26)27)11-15(14)20(22)25/h3-4,9-11H,5-8H2,1-2H3