3-[2-chloranyl-5-[(4,5-dimethyl-6-oxidanylidene-1H-pyridazin-3-yl)methyl]phenoxy]benzenecarbonitrile

Systemtic Name: 3-[2-chloranyl-5-[(4,5-dimethyl-6-oxidanylidene-1H-pyridazin-3-yl)methyl]phenoxy]benzenecarbonitrile Openeye Name: 3-[2-chloro-5-[(4,5-dimethyl-6-oxo-1H-pyridazin-3-yl)methyl]phenoxy]benzonitrile CAS Name: 3-[2-chloro-5-[(4,5-dimethyl-6-oxo-1H-pyridazin-3-yl)methyl]phenoxy]benzonitrile IUPAC Name: 3-[2-chloro-5-[(4,5-dimethyl-6-oxo-1H-pyridazin-3-yl)methyl]phenoxy]benzonitrile Traditional Name: 3-[2-chloro-5-[(6-keto-4,5-dimethyl-1H-pyridazin-3-yl)methyl]phenoxy]benzonitrile Formula: C20H16ClN3O2 MolecularWeight: 365.81294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1CC2=CC(=C(C=C2)Cl)OC3=CC=CC(=C3)C#N)C

Isomeric SMILES

CC1=C(C(=O)NN=C1CC2=CC(=C(C=C2)Cl)OC3=CC=CC(=C3)C#N)C

InChI

InChI=1S/C20H16ClN3O2/c1-12-13(2)20(25)24-23-18(12)9-14-6-7-17(21)19(10-14)26-16-5-3-4-15(8-16)11-22/h3-8,10H,9H2,1-2H3,(H,24,25)