2,2-dimethyl-5-[(E)-3-phenylprop-2-enyl]-5-(piperidin-1-ylmethyl)-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[(E)-3-phenylprop-2-enyl]-5-(piperidin-1-ylmethyl)-1,3-dioxane-4,6-dione Openeye Name: 5-[(E)-cinnamyl]-2,2-dimethyl-5-(1-piperidylmethyl)-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-[(E)-3-phenylprop-2-enyl]-5-(1-piperidinylmethyl)-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[(E)-3-phenylprop-2-enyl]-5-(piperidin-1-ylmethyl)-1,3-dioxane-4,6-dione Traditional Name: 5-[(E)-cinnamyl]-2,2-dimethyl-5-(piperidinomethyl)-1,3-dioxane-4,6-quinone Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)(CC=CC2=CC=CC=C2)CN3CCCCC3)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)(C/C=C/C2=CC=CC=C2)CN3CCCCC3)C

InChI

InChI=1S/C21H27NO4/c1-20(2)25-18(23)21(19(24)26-20,16-22-14-7-4-8-15-22)13-9-12-17-10-5-3-6-11-17/h3,5-6,9-12H,4,7-8,13-16H2,1-2H3/b12-9+