(3E)-5-tert-butyl-3-[(4-cyanophenyl)hydrazinylidene]-2-methyl-N-(2-methyl-4-nitro-phenyl)-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxamide

Systemtic Name: (3E)-5-tert-butyl-3-[(4-cyanophenyl)hydrazinylidene]-2-methyl-N-(2-methyl-4-nitro-phenyl)-6-oxidanylidene-cyclohexa-1,4-diene-1-carboxamide Openeye Name: (3E)-5-tert-butyl-3-[(4-cyanophenyl)hydrazono]-2-methyl-N-(2-methyl-4-nitro-phenyl)-6-oxo-cyclohexa-1,4-diene-1-carboxamide CAS Name: (3E)-5-tert-butyl-3-[(4-cyanophenyl)hydrazinylidene]-2-methyl-N-(2-methyl-4-nitrophenyl)-6-oxo-1-cyclohexa-1,4-dienecarboxamide IUPAC Name: (3E)-5-tert-butyl-3-[(4-cyanophenyl)hydrazinylidene]-2-methyl-N-(2-methyl-4-nitrophenyl)-6-oxocyclohexa-1,4-diene-1-carboxamide Traditional Name: (3E)-5-tert-butyl-3-[(4-cyanophenyl)hydrazono]-6-keto-2-methyl-N-(2-methyl-4-nitro-phenyl)cyclohexa-1,4-diene-1-carboxamide Formula: C26H25N5O4 MolecularWeight: 471.5078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=C(C(=NNC3=CC=C(C=C3)C#N)C=C(C2=O)C(C)(C)C)C

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=C(/C(=N/NC3=CC=C(C=C3)C#N)/C=C(C2=O)C(C)(C)C)C

InChI

InChI=1S/C26H25N5O4/c1-15-12-19(31(34)35)10-11-21(15)28-25(33)23-16(2)22(13-20(24(23)32)26(3,4)5)30-29-18-8-6-17(14-27)7-9-18/h6-13,29H,1-5H3,(H,28,33)/b30-22+