1-(4-bromanyl-3-methyl-phenyl)-5-[(3-ethoxy-4-oxidanyl-5-prop-2-enyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-5-[(3-ethoxy-4-oxidanyl-5-prop-2-enyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-allyl-5-ethoxy-4-hydroxy-phenyl)methylene]-1-(4-bromo-3-methyl-phenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-bromo-3-methylphenyl)-5-[(3-ethoxy-4-hydroxy-5-prop-2-enylphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-bromo-3-methylphenyl)-5-[(3-ethoxy-4-hydroxy-5-prop-2-enylphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-allyl-5-ethoxy-4-hydroxy-benzylidene)-1-(4-bromo-3-methyl-phenyl)barbituric acid Formula: C23H21BrN2O5 MolecularWeight: 485.32724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)CC=C)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=C(C=C3)Br)C

Isomeric SMILES

CCOC1=CC(=CC(=C1O)CC=C)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=C(C=C3)Br)C

InChI

InChI=1S/C23H21BrN2O5/c1-4-6-15-10-14(12-19(20(15)27)31-5-2)11-17-21(28)25-23(30)26(22(17)29)16-7-8-18(24)13(3)9-16/h4,7-12,27H,1,5-6H2,2-3H3,(H,25,28,30)