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

Systemtic Name: 5-[butylamino-[(4-nitrophenyl)amino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[butylamino-(4-nitroanilino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[butylamino-(4-nitroanilino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[butylamino-(4-nitroanilino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[butylamino-(4-nitroanilino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C17H21N3O6 MolecularWeight: 363.36514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=C1C(=O)OC(OC1=O)(C)C)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=C1C(=O)OC(OC1=O)(C)C)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O6/c1-4-5-10-18-14(13-15(21)25-17(2,3)26-16(13)22)19-11-6-8-12(9-7-11)20(23)24/h6-9,18-19H,4-5,10H2,1-3H3