4-chloranyl-3-nitro-N'-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzohydrazide

Systemtic Name: 4-chloranyl-3-nitro-N'-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzohydrazide Openeye Name: 4-chloro-N'-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: 4-chloro-3-nitro-N'-[5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinyl]benzohydrazide IUPAC Name: 4-chloro-3-nitro-N'-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]benzohydrazide Traditional Name: 4-chloro-N'-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C20H17ClN6O6 MolecularWeight: 472.83858

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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)Cl)[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)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H17ClN6O6/c1-11(2)12-3-6-14(7-4-12)33-20-17(27(31)32)18(22-10-23-20)24-25-19(28)13-5-8-15(21)16(9-13)26(29)30/h3-11H,1-2H3,(H,25,28)(H,22,23,24)