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

Systemtic Name: 2-methyl-5-[(4-nitrophenyl)methylidene]-2-phenethyl-1,3-dioxane-4,6-dione Openeye Name: 2-methyl-5-[(4-nitrophenyl)methylene]-2-phenethyl-1,3-dioxane-4,6-dione CAS Name: 2-methyl-5-[(4-nitrophenyl)methylidene]-2-phenethyl-1,3-dioxane-4,6-dione IUPAC Name: 2-methyl-5-[(4-nitrophenyl)methylidene]-2-phenethyl-1,3-dioxane-4,6-dione Traditional Name: 2-methyl-5-(4-nitrobenzylidene)-2-phenethyl-1,3-dioxane-4,6-quinone Formula: C20H17NO6 MolecularWeight: 367.35208

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O1)CCC3=CC=CC=C3

Isomeric SMILES

CC1(OC(=O)C(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O1)CCC3=CC=CC=C3

InChI

InChI=1S/C20H17NO6/c1-20(12-11-14-5-3-2-4-6-14)26-18(22)17(19(23)27-20)13-15-7-9-16(10-8-15)21(24)25/h2-10,13H,11-12H2,1H3