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

Systemtic Name: 5-[[(3-bromophenyl)amino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[(3-bromoanilino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[(3-bromoanilino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[(3-bromoanilino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[(3-bromoanilino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C13H12BrNO4 MolecularWeight: 326.14268

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CNC2=CC(=CC=C2)Br)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CNC2=CC(=CC=C2)Br)C(=O)O1)C

InChI

InChI=1S/C13H12BrNO4/c1-13(2)18-11(16)10(12(17)19-13)7-15-9-5-3-4-8(14)6-9/h3-7,15H,1-2H3