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

Systemtic Name: 3-[(E)-2-(4-butoxyphenyl)ethenyl]-4-methyl-6-oxidanylidene-1H-pyridazine-5-carbonitrile Openeye Name: 3-[(E)-2-(4-butoxyphenyl)vinyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile CAS Name: 3-[(E)-2-(4-butoxyphenyl)ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile IUPAC Name: 3-[(E)-2-(4-butoxyphenyl)ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile Traditional Name: 3-[(E)-2-(4-butoxyphenyl)vinyl]-6-keto-4-methyl-1H-pyridazine-5-carbonitrile Formula: C18H19N3O2 MolecularWeight: 309.36236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=CC2=NNC(=O)C(=C2C)C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C/C2=NNC(=O)C(=C2C)C#N

InChI

InChI=1S/C18H19N3O2/c1-3-4-11-23-15-8-5-14(6-9-15)7-10-17-13(2)16(12-19)18(22)21-20-17/h5-10H,3-4,11H2,1-2H3,(H,21,22)/b10-7+