1-(3-chlorophenyl)-5-[(3-methoxy-4-oxidanyl-5-prop-2-enyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(3-chlorophenyl)-5-[(3-methoxy-4-oxidanyl-5-prop-2-enyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-allyl-4-hydroxy-5-methoxy-phenyl)methylene]-1-(3-chlorophenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(3-chlorophenyl)-5-[(4-hydroxy-3-methoxy-5-prop-2-enylphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(3-chlorophenyl)-5-[(4-hydroxy-3-methoxy-5-prop-2-enylphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-allyl-4-hydroxy-5-methoxy-benzylidene)-1-(3-chlorophenyl)barbituric acid Formula: C21H17ClN2O5 MolecularWeight: 412.82308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)CC=C)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC(=CC(=C1O)CC=C)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H17ClN2O5/c1-3-5-13-8-12(10-17(29-2)18(13)25)9-16-19(26)23-21(28)24(20(16)27)15-7-4-6-14(22)11-15/h3-4,6-11,25H,1,5H2,2H3,(H,23,26,28)