N'-[2-(4-chloranylphenoxy)ethanoyl]-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanehydrazide

Systemtic Name: N'-[2-(4-chloranylphenoxy)ethanoyl]-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanehydrazide Openeye Name: N'-[2-(4-chlorophenoxy)acetyl]-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetohydrazide CAS Name: N'-[2-(4-chlorophenoxy)-1-oxoethyl]-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]acetohydrazide IUPAC Name: N'-[2-(4-chlorophenoxy)acetyl]-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetohydrazide Traditional Name: N'-[2-(4-chlorophenoxy)acetyl]-2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]acetohydrazide Formula: C18H22ClN6O3+ MolecularWeight: 405.85868

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NNC(=O)COC2=CC=C(C=C2)Cl)C3=NC=CC=N3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NNC(=O)COC2=CC=C(C=C2)Cl)C3=NC=CC=N3

InChI

InChI=1S/C18H21ClN6O3/c19-14-2-4-15(5-3-14)28-13-17(27)23-22-16(26)12-24-8-10-25(11-9-24)18-20-6-1-7-21-18/h1-7H,8-13H2,(H,22,26)(H,23,27)/p+1