5-(1,3-benzodioxol-5-ylmethyl)-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-1-(4-ethylphenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1-(4-ethylphenyl)-5-piperonyl-barbituric acid Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18N2O5/c1-2-12-3-6-14(7-4-12)22-19(24)15(18(23)21-20(22)25)9-13-5-8-16-17(10-13)27-11-26-16/h3-8,10,15H,2,9,11H2,1H3,(H,21,23,25)