5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2-ethoxyphenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2-ethoxyphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylene]-1-(2-ethoxyphenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2-ethoxyphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2-ethoxyphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1-o-phenetyl-5-[(piperonylamino)methylene]barbituric acid Formula: C21H19N3O6 MolecularWeight: 409.39206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=O)C(=CNCC3=CC4=C(C=C3)OCO4)C(=O)NC2=O

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=O)C(=CNCC3=CC4=C(C=C3)OCO4)C(=O)NC2=O

InChI

InChI=1S/C21H19N3O6/c1-2-28-16-6-4-3-5-15(16)24-20(26)14(19(25)23-21(24)27)11-22-10-13-7-8-17-18(9-13)30-12-29-17/h3-9,11,22H,2,10,12H2,1H3,(H,23,25,27)