5-[1-(2,5-dihydropyrrol-1-yl)octylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[1-(2,5-dihydropyrrol-1-yl)octylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[1-(2,5-dihydropyrrol-1-yl)octylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[1-(2,5-dihydropyrrol-1-yl)octylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[1-(2,5-dihydropyrrol-1-yl)octylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5-[1-(3-pyrrolin-1-yl)octylidene]-1,3-dioxane-4,6-quinone Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=C1C(=O)OC(OC1=O)(C)C)N2CC=CC2

Isomeric SMILES

CCCCCCCC(=C1C(=O)OC(OC1=O)(C)C)N2CC=CC2

InChI

InChI=1S/C18H27NO4/c1-4-5-6-7-8-11-14(19-12-9-10-13-19)15-16(20)22-18(2,3)23-17(15)21/h9-10H,4-8,11-13H2,1-3H3