2,2-dimethyl-5-[[(3-nitrophenyl)amino]methylidene]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[[(3-nitrophenyl)amino]methylidene]-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-[(3-nitroanilino)methylene]-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-[(3-nitroanilino)methylidene]-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[(3-nitroanilino)methylidene]-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5-[(3-nitroanilino)methylene]-1,3-dioxane-4,6-quinone Formula: C13H12N2O6 MolecularWeight: 292.24418

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CNC2=CC(=CC=C2)[N+](=O)[O-])C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CNC2=CC(=CC=C2)[N+](=O)[O-])C(=O)O1)C

InChI

InChI=1S/C13H12N2O6/c1-13(2)20-11(16)10(12(17)21-13)7-14-8-4-3-5-9(6-8)15(18)19/h3-7,14H,1-2H3