2,2-dimethyl-5-(1-pentylpyridin-4-ylidene)-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-(1-pentylpyridin-4-ylidene)-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-(1-pentyl-4-pyridylidene)-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-(1-pentyl-4-pyridinylidene)-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-(1-pentylpyridin-4-ylidene)-1,3-dioxane-4,6-dione Traditional Name: 5-(1-amyl-4-pyridylidene)-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C16H21NO4 MolecularWeight: 291.34224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=CC(=C2C(=O)OC(OC2=O)(C)C)C=C1

Isomeric SMILES

CCCCCN1C=CC(=C2C(=O)OC(OC2=O)(C)C)C=C1

InChI

InChI=1S/C16H21NO4/c1-4-5-6-9-17-10-7-12(8-11-17)13-14(18)20-16(2,3)21-15(13)19/h7-8,10-11H,4-6,9H2,1-3H3