3-[(E)-2-(2-butyl-1-benzofuran-3-yl)ethenyl]-4-methyl-6-oxidanylidene-1H-pyridazine-5-carbonitrile

Systemtic Name: 3-[(E)-2-(2-butyl-1-benzofuran-3-yl)ethenyl]-4-methyl-6-oxidanylidene-1H-pyridazine-5-carbonitrile Openeye Name: 3-[(E)-2-(2-butylbenzofuran-3-yl)vinyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile CAS Name: 3-[(E)-2-(2-butyl-3-benzofuranyl)ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile IUPAC Name: 3-[(E)-2-(2-butyl-1-benzofuran-3-yl)ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile Traditional Name: 3-[(E)-2-(2-butylbenzofuran-3-yl)vinyl]-6-keto-4-methyl-1H-pyridazine-5-carbonitrile Formula: C20H19N3O2 MolecularWeight: 333.38376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)C=CC3=NNC(=O)C(=C3C)C#N

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)/C=C/C3=NNC(=O)C(=C3C)C#N

InChI

InChI=1S/C20H19N3O2/c1-3-4-8-18-15(14-7-5-6-9-19(14)25-18)10-11-17-13(2)16(12-21)20(24)23-22-17/h5-7,9-11H,3-4,8H2,1-2H3,(H,23,24)/b11-10+