5-[[3-bromanyl-5-ethoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[3-bromanyl-5-ethoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[3-bromo-5-ethoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylene]-1-cyclohexyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[3-bromo-5-ethoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[3-bromo-5-ethoxy-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[3-bromo-5-ethoxy-4-(4-nitrobenzyl)oxy-benzylidene]-1-cyclohexyl-barbituric acid Formula: C26H26BrN3O7 MolecularWeight: 572.40454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)Br)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)Br)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H26BrN3O7/c1-2-36-22-14-17(13-21(27)23(22)37-15-16-8-10-19(11-9-16)30(34)35)12-20-24(31)28-26(33)29(25(20)32)18-6-4-3-5-7-18/h8-14,18H,2-7,15H2,1H3,(H,28,31,33)