4-nitro-N'-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzohydrazide

Systemtic Name: 4-nitro-N'-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide CAS Name: 4-nitro-N'-[5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinyl]benzohydrazide IUPAC Name: 4-nitro-N'-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzohydrazide Traditional Name: N'-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-4-nitro-benzohydrazide Formula: C20H18N6O6 MolecularWeight: 438.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N6O6/c1-12(2)13-5-9-16(10-6-13)32-20-17(26(30)31)18(21-11-22-20)23-24-19(27)14-3-7-15(8-4-14)25(28)29/h3-12H,1-2H3,(H,24,27)(H,21,22,23)