3-methoxy-4-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]oxy-benzohydrazide

Systemtic Name: 3-methoxy-4-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]oxy-benzohydrazide Openeye Name: 3-methoxy-4-[5-nitro-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidin-4-yl]oxy-benzohydrazide CAS Name: 3-methoxy-4-[[5-nitro-6-[4-(2-pyridinyl)-1-piperazinyl]-4-pyrimidinyl]oxy]benzohydrazide IUPAC Name: 3-methoxy-4-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]oxybenzohydrazide Traditional Name: 3-methoxy-4-[5-nitro-6-[4-(2-pyridyl)piperazino]pyrimidin-4-yl]oxy-benzohydrazide Formula: C21H22N8O5 MolecularWeight: 466.44998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NN)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NN)OC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C21H22N8O5/c1-33-16-12-14(20(30)26-22)5-6-15(16)34-21-18(29(31)32)19(24-13-25-21)28-10-8-27(9-11-28)17-4-2-3-7-23-17/h2-7,12-13H,8-11,22H2,1H3,(H,26,30)