2,2-dimethyl-5-[(E)-3-(1H-pyrrol-2-yl)prop-2-enylidene]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[(E)-3-(1H-pyrrol-2-yl)prop-2-enylidene]-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-[(E)-3-(1H-pyrrol-2-yl)prop-2-enylidene]-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-[(E)-3-(1H-pyrrol-2-yl)prop-2-enylidene]-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[(E)-3-(1H-pyrrol-2-yl)prop-2-enylidene]-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5-[(E)-3-(1H-pyrrol-2-yl)prop-2-enylidene]-1,3-dioxane-4,6-quinone Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CC=CC2=CC=CN2)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=C/C=C/C2=CC=CN2)C(=O)O1)C

InChI

InChI=1S/C13H13NO4/c1-13(2)17-11(15)10(12(16)18-13)7-3-5-9-6-4-8-14-9/h3-8,14H,1-2H3/b5-3+