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

Systemtic Name: 5-[[[4-(azepan-1-ylcarbonyl)phenyl]amino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[[4-(azepane-1-carbonyl)anilino]methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[[4-[1-azepanyl(oxo)methyl]anilino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[[4-(azepane-1-carbonyl)anilino]methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[[4-(azepane-1-carbonyl)anilino]methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CNC2=CC=C(C=C2)C(=O)N3CCCCCC3)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CNC2=CC=C(C=C2)C(=O)N3CCCCCC3)C(=O)O1)C

InChI

InChI=1S/C20H24N2O5/c1-20(2)26-18(24)16(19(25)27-20)13-21-15-9-7-14(8-10-15)17(23)22-11-5-3-4-6-12-22/h7-10,13,21H,3-6,11-12H2,1-2H3