4-[3-[4,5-bis(chloranyl)-6-oxidanylidene-pyridazin-1-yl]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-[4,5-bis(chloranyl)-6-oxidanylidene-pyridazin-1-yl]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 4-[3-(4,5-dichloro-6-oxo-pyridazin-1-yl)-2-hydroxy-propoxy]benzonitrile CAS Name: 4-[3-(4,5-dichloro-6-oxo-1-pyridazinyl)-2-hydroxypropoxy]benzonitrile IUPAC Name: 4-[3-(4,5-dichloro-6-oxopyridazin-1-yl)-2-hydroxypropoxy]benzonitrile Traditional Name: 4-[3-(4,5-dichloro-6-keto-pyridazin-1-yl)-2-hydroxy-propoxy]benzonitrile Formula: C14H11Cl2N3O3 MolecularWeight: 340.16144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OCC(CN2C(=O)C(=C(C=N2)Cl)Cl)O

Isomeric SMILES

C1=CC(=CC=C1C#N)OCC(CN2C(=O)C(=C(C=N2)Cl)Cl)O

InChI

InChI=1S/C14H11Cl2N3O3/c15-12-6-18-19(14(21)13(12)16)7-10(20)8-22-11-3-1-9(5-17)2-4-11/h1-4,6,10,20H,7-8H2