2-[(2-bromanyl-4,5-diethoxy-phenyl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 2-[(2-bromanyl-4,5-diethoxy-phenyl)methyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-[(2-bromo-4,5-diethoxy-phenyl)methyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[(2-bromo-4,5-diethoxyphenyl)methyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[(2-bromo-4,5-diethoxyphenyl)methyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-(2-bromo-4,5-diethoxy-benzyl)-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C18H20BrN3O3 MolecularWeight: 406.2737

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CN2C(=O)C(=C(C(=N2)C)C)C#N)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CN2C(=O)C(=C(C(=N2)C)C)C#N)Br)OCC

InChI

InChI=1S/C18H20BrN3O3/c1-5-24-16-7-13(15(19)8-17(16)25-6-2)10-22-18(23)14(9-20)11(3)12(4)21-22/h7-8H,5-6,10H2,1-4H3