(5E)-1-butyl-5-[[(4-methyl-3-nitro-phenyl)amino]methylidene]-3-octyl-1,3-diazinane-2,4,6-trione

Systemtic Name: (5E)-1-butyl-5-[[(4-methyl-3-nitro-phenyl)amino]methylidene]-3-octyl-1,3-diazinane-2,4,6-trione Openeye Name: (5E)-1-butyl-5-[(4-methyl-3-nitro-anilino)methylene]-3-octyl-hexahydropyrimidine-2,4,6-trione CAS Name: (5E)-1-butyl-5-[(4-methyl-3-nitroanilino)methylidene]-3-octyl-1,3-diazinane-2,4,6-trione IUPAC Name: (5E)-1-butyl-5-[(4-methyl-3-nitroanilino)methylidene]-3-octyl-1,3-diazinane-2,4,6-trione Traditional Name: (5E)-1-butyl-5-[(4-methyl-3-nitro-anilino)methylene]-3-octyl-barbituric acid Formula: C24H34N4O5 MolecularWeight: 458.55056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=O)C(=CNC2=CC(=C(C=C2)C)[N+](=O)[O-])C(=O)N(C1=O)CCCC

Isomeric SMILES

CCCCCCCCN1C(=O)/C(=C/NC2=CC(=C(C=C2)C)[N+](=O)[O-])/C(=O)N(C1=O)CCCC

InChI

InChI=1S/C24H34N4O5/c1-4-6-8-9-10-11-15-27-23(30)20(22(29)26(24(27)31)14-7-5-2)17-25-19-13-12-18(3)21(16-19)28(32)33/h12-13,16-17,25H,4-11,14-15H2,1-3H3/b20-17+