4-chloranyl-N'-[6-(2-ethylpiperidin-1-yl)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide

Systemtic Name: 4-chloranyl-N'-[6-(2-ethylpiperidin-1-yl)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: 4-chloro-N'-[6-(2-ethyl-1-piperidyl)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: 4-chloro-N'-[6-(2-ethyl-1-piperidinyl)-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: 4-chloro-N'-[6-(2-ethylpiperidin-1-yl)-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: 4-chloro-N'-[6-(2-ethylpiperidino)-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C18H20ClN7O5 MolecularWeight: 449.8483

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H20ClN7O5/c1-2-12-5-3-4-8-24(12)17-15(26(30)31)16(20-10-21-17)22-23-18(27)11-6-7-13(19)14(9-11)25(28)29/h6-7,9-10,12H,2-5,8H2,1H3,(H,23,27)(H,20,21,22)