2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C16H14ClN3O3 MolecularWeight: 331.75366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC2=C3C(=CC(=C2)Cl)COCO3)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC2=C3C(=CC(=C2)Cl)COCO3)C#N

InChI

InChI=1S/C16H14ClN3O3/c1-9-10(2)19-20(16(21)14(9)5-18)6-11-3-13(17)4-12-7-22-8-23-15(11)12/h3-4H,6-8H2,1-2H3