ethyl 4-iodanyl-2-piperazin-1-yl-3-pyridazin-3-yl-benzenecarboperoxoate

Systemtic Name: ethyl 4-iodanyl-2-piperazin-1-yl-3-pyridazin-3-yl-benzenecarboperoxoate Openeye Name: ethyl 4-iodo-2-piperazin-1-yl-3-pyridazin-3-yl-benzenecarboperoxoate CAS Name: 4-iodo-2-(1-piperazinyl)-3-(3-pyridazinyl)benzenecarboperoxoic acid ethyl ester IUPAC Name: ethyl 4-iodo-2-piperazin-1-yl-3-pyridazin-3-ylbenzenecarboperoxoate Traditional Name: 4-iodo-2-piperazino-3-pyridazin-3-yl-benzenecarboperoxoic acid ethyl ester Formula: C17H19IN4O3 MolecularWeight: 454.26223

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Descriptors Computed from Structure

Canonical SMILES:

CCOOC(=O)C1=C(C(=C(C=C1)I)C2=NN=CC=C2)N3CCNCC3

Isomeric SMILES

CCOOC(=O)C1=C(C(=C(C=C1)I)C2=NN=CC=C2)N3CCNCC3

InChI

InChI=1S/C17H19IN4O3/c1-2-24-25-17(23)12-5-6-13(18)15(14-4-3-7-20-21-14)16(12)22-10-8-19-9-11-22/h3-7,19H,2,8-11H2,1H3