2,2-dimethyl-5,5-bis(2-pyridin-4-ylethyl)-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5,5-bis(2-pyridin-4-ylethyl)-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5,5-bis[2-(4-pyridyl)ethyl]-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5,5-bis(2-pyridin-4-ylethyl)-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5,5-bis(2-pyridin-4-ylethyl)-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5,5-bis[2-(4-pyridyl)ethyl]-1,3-dioxane-4,6-quinone Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)(CCC2=CC=NC=C2)CCC3=CC=NC=C3)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)(CCC2=CC=NC=C2)CCC3=CC=NC=C3)C

InChI

InChI=1S/C20H22N2O4/c1-19(2)25-17(23)20(18(24)26-19,9-3-15-5-11-21-12-6-15)10-4-16-7-13-22-14-8-16/h5-8,11-14H,3-4,9-10H2,1-2H3