5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-1-cyclohexyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-1-cyclohexyl-barbituric acid Formula: C18H17BrN2O5 MolecularWeight: 421.24198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CC3=CC4=C(C=C3Br)OCO4)C(=O)NC2=O

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(=CC3=CC4=C(C=C3Br)OCO4)C(=O)NC2=O

InChI

InChI=1S/C18H17BrN2O5/c19-13-8-15-14(25-9-26-15)7-10(13)6-12-16(22)20-18(24)21(17(12)23)11-4-2-1-3-5-11/h6-8,11H,1-5,9H2,(H,20,22,24)