1-cyclohexyl-5-[(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-cyclohexyl-5-[(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4-benzyloxy-5-methoxy-2-nitro-phenyl)methylene]-1-cyclohexyl-hexahydropyrimidine-2,4,6-trione CAS Name: 1-cyclohexyl-5-[(5-methoxy-2-nitro-4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-cyclohexyl-5-[(5-methoxy-2-nitro-4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(4-benzoxy-5-methoxy-2-nitro-benzylidene)-1-cyclohexyl-barbituric acid Formula: C25H25N3O7 MolecularWeight: 479.4819

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)[N+](=O)[O-])OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C(=C1)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)[N+](=O)[O-])OCC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O7/c1-34-21-13-17(20(28(32)33)14-22(21)35-15-16-8-4-2-5-9-16)12-19-23(29)26-25(31)27(24(19)30)18-10-6-3-7-11-18/h2,4-5,8-9,12-14,18H,3,6-7,10-11,15H2,1H3,(H,26,29,31)