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

Systemtic Name: 5-[(4-bromophenyl)-piperidin-1-yl-methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[(4-bromophenyl)-(1-piperidyl)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[(4-bromophenyl)-(1-piperidinyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[(4-bromophenyl)-piperidin-1-ylmethylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[(4-bromophenyl)-piperidino-methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C18H20BrNO4 MolecularWeight: 394.2597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=C(C2=CC=C(C=C2)Br)N3CCCCC3)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=C(C2=CC=C(C=C2)Br)N3CCCCC3)C(=O)O1)C

InChI

InChI=1S/C18H20BrNO4/c1-18(2)23-16(21)14(17(22)24-18)15(20-10-4-3-5-11-20)12-6-8-13(19)9-7-12/h6-9H,3-5,10-11H2,1-2H3