2,2-dimethyl-5-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylene]-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-dioxane-4,6-dione Traditional Name: 5-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C(=O)OC(OC3=O)(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C(=O)OC(OC3=O)(C)C

InChI

InChI=1S/C17H16N2O5/c1-10-12(9-13-15(21)23-17(2,3)24-16(13)22)14(20)19(18-10)11-7-5-4-6-8-11/h4-9,18H,1-3H3