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

Systemtic Name: 3-nitro-N'-[5-nitro-6-(2-piperidin-1-ylethylamino)pyrimidin-4-yl]benzohydrazide Openeye Name: 3-nitro-N'-[5-nitro-6-[2-(1-piperidyl)ethylamino]pyrimidin-4-yl]benzohydrazide CAS Name: 3-nitro-N'-[5-nitro-6-[2-(1-piperidinyl)ethylamino]-4-pyrimidinyl]benzohydrazide IUPAC Name: 3-nitro-N'-[5-nitro-6-(2-piperidin-1-ylethylamino)pyrimidin-4-yl]benzohydrazide Traditional Name: 3-nitro-N'-[5-nitro-6-(2-piperidinoethylamino)pyrimidin-4-yl]benzohydrazide Formula: C18H22N8O5 MolecularWeight: 430.41788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC2=C(C(=NC=N2)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CCNC2=C(C(=NC=N2)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H22N8O5/c27-18(13-5-4-6-14(11-13)25(28)29)23-22-17-15(26(30)31)16(20-12-21-17)19-7-10-24-8-2-1-3-9-24/h4-6,11-12H,1-3,7-10H2,(H,23,27)(H2,19,20,21,22)