5-(1,3-benzodioxol-5-ylmethylidene)-1-(2,5-diethoxyphenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethylidene)-1-(2,5-diethoxyphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1,3-benzodioxol-5-ylmethylene)-1-(2,5-diethoxyphenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1,3-benzodioxol-5-ylmethylidene)-1-(2,5-diethoxyphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1,3-benzodioxol-5-ylmethylidene)-1-(2,5-diethoxyphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1-(2,5-diethoxyphenyl)-5-piperonylidene-barbituric acid Formula: C22H20N2O7 MolecularWeight: 424.4034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)N2C(=O)C(=CC3=CC4=C(C=C3)OCO4)C(=O)NC2=O

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)N2C(=O)C(=CC3=CC4=C(C=C3)OCO4)C(=O)NC2=O

InChI

InChI=1S/C22H20N2O7/c1-3-28-14-6-8-17(29-4-2)16(11-14)24-21(26)15(20(25)23-22(24)27)9-13-5-7-18-19(10-13)31-12-30-18/h5-11H,3-4,12H2,1-2H3,(H,23,25,27)