4-tert-butyl-N-[1-[3-(3-nitrophenyl)-5-oxidanylidene-2H-1,2,4-triazin-6-yl]propyl]cyclohexane-1-carboxamide

Systemtic Name: 4-tert-butyl-N-[1-[3-(3-nitrophenyl)-5-oxidanylidene-2H-1,2,4-triazin-6-yl]propyl]cyclohexane-1-carboxamide Openeye Name: 4-tert-butyl-N-[1-[3-(3-nitrophenyl)-5-oxo-2H-1,2,4-triazin-6-yl]propyl]cyclohexanecarboxamide CAS Name: 4-tert-butyl-N-[1-[3-(3-nitrophenyl)-5-oxo-2H-1,2,4-triazin-6-yl]propyl]-1-cyclohexanecarboxamide IUPAC Name: 4-tert-butyl-N-[1-[3-(3-nitrophenyl)-5-oxo-2H-1,2,4-triazin-6-yl]propyl]cyclohexane-1-carboxamide Traditional Name: 4-tert-butyl-N-[1-[5-keto-3-(3-nitrophenyl)-2H-1,2,4-triazin-6-yl]propyl]cyclohexanecarboxamide Formula: C23H31N5O4 MolecularWeight: 441.52334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NNC(=NC1=O)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3CCC(CC3)C(C)(C)C

Isomeric SMILES

CCC(C1=NNC(=NC1=O)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3CCC(CC3)C(C)(C)C

InChI

InChI=1S/C23H31N5O4/c1-5-18(24-21(29)14-9-11-16(12-10-14)23(2,3)4)19-22(30)25-20(27-26-19)15-7-6-8-17(13-15)28(31)32/h6-8,13-14,16,18H,5,9-12H2,1-4H3,(H,24,29)(H,25,27,30)