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

Systemtic Name: 2,4-bis(chloranyl)-N'-[6-(2-ethylpiperidin-1-yl)-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 2,4-dichloro-N'-[6-(2-ethyl-1-piperidyl)-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: 2,4-dichloro-N'-[6-(2-ethyl-1-piperidinyl)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 2,4-dichloro-N'-[6-(2-ethylpiperidin-1-yl)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 2,4-dichloro-N'-[6-(2-ethylpiperidino)-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C18H20Cl2N6O3 MolecularWeight: 439.2958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20Cl2N6O3/c1-2-12-5-3-4-8-25(12)17-15(26(28)29)16(21-10-22-17)23-24-18(27)13-7-6-11(19)9-14(13)20/h6-7,9-10,12H,2-5,8H2,1H3,(H,24,27)(H,21,22,23)