N'-[6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide

Systemtic Name: N'-[6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide Openeye Name: N'-[6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide CAS Name: N'-[6-[4-(3-chlorophenyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]-2-phenoxyacetohydrazide IUPAC Name: N'-[6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]-2-phenoxyacetohydrazide Traditional Name: N'-[6-[4-(3-chlorophenyl)piperazino]-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide Formula: C22H22ClN7O4 MolecularWeight: 483.90758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)NNC(=O)COC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)NNC(=O)COC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22ClN7O4/c23-16-5-4-6-17(13-16)28-9-11-29(12-10-28)22-20(30(32)33)21(24-15-25-22)27-26-19(31)14-34-18-7-2-1-3-8-18/h1-8,13,15H,9-12,14H2,(H,26,31)(H,24,25,27)