N'-[6-[4-(2-hydroxyethyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: N'-[6-[4-(2-hydroxyethyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-[4-(2-hydroxyethyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: N'-[6-[4-(2-hydroxyethyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[6-[4-(2-hydroxyethyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: N'-[6-[4-(2-hydroxyethyl)piperazino]-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C17H21N7O4 MolecularWeight: 387.39314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCO)C2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N7O4/c25-11-10-22-6-8-23(9-7-22)16-14(24(27)28)15(18-12-19-16)20-21-17(26)13-4-2-1-3-5-13/h1-5,12,25H,6-11H2,(H,21,26)(H,18,19,20)