N'-[6-(tert-butylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide

Systemtic Name: N'-[6-(tert-butylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: N'-[6-(tert-butylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: N'-[6-(tert-butylamino)-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: N'-[6-(tert-butylamino)-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: N'-[6-(tert-butylamino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C15H17N7O5 MolecularWeight: 375.33938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C(=NC=N1)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC1=C(C(=NC=N1)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H17N7O5/c1-15(2,3)18-12-11(22(26)27)13(17-8-16-12)19-20-14(23)9-5-4-6-10(7-9)21(24)25/h4-8H,1-3H3,(H,20,23)(H2,16,17,18,19)