5-[(4-butan-2-yloxy-3-chloranyl-5-ethoxy-phenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(4-butan-2-yloxy-3-chloranyl-5-ethoxy-phenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-chloro-5-ethoxy-4-sec-butoxy-phenyl)methylene]-1-(2-furylmethyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(4-butan-2-yloxy-3-chloro-5-ethoxyphenyl)methylidene]-1-(2-furanylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(4-butan-2-yloxy-3-chloro-5-ethoxyphenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-chloro-5-ethoxy-4-sec-butoxy-benzylidene)-1-(2-furfuryl)barbituric acid Formula: C22H23ClN2O6 MolecularWeight: 446.88082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1Cl)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3)OCC

Isomeric SMILES

CCC(C)OC1=C(C=C(C=C1Cl)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3)OCC

InChI

InChI=1S/C22H23ClN2O6/c1-4-13(3)31-19-17(23)10-14(11-18(19)29-5-2)9-16-20(26)24-22(28)25(21(16)27)12-15-7-6-8-30-15/h6-11,13H,4-5,12H2,1-3H3,(H,24,26,28)