4-chloranyl-N'-[6-(4-ethylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide

Systemtic Name: 4-chloranyl-N'-[6-(4-ethylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: 4-chloro-N'-[6-(4-ethylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: 4-chloro-N'-[6-(4-ethyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: 4-chloro-N'-[6-(4-ethylpiperazin-1-yl)-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: 4-chloro-N'-[6-(4-ethylpiperazino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C17H19ClN8O5 MolecularWeight: 450.83636

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H19ClN8O5/c1-2-23-5-7-24(8-6-23)16-14(26(30)31)15(19-10-20-16)21-22-17(27)11-3-4-12(18)13(9-11)25(28)29/h3-4,9-10H,2,5-8H2,1H3,(H,22,27)(H,19,20,21)