methyl 4-[[2-[(E)-2-(5-cyano-4-methyl-6-oxidanylidene-1H-pyridazin-3-yl)ethenyl]phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[2-[(E)-2-(5-cyano-4-methyl-6-oxidanylidene-1H-pyridazin-3-yl)ethenyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[2-[(E)-2-(5-cyano-4-methyl-6-oxo-1H-pyridazin-3-yl)vinyl]phenoxy]methyl]benzoate CAS Name: 4-[[2-[(E)-2-(5-cyano-4-methyl-6-oxo-1H-pyridazin-3-yl)ethenyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(E)-2-(5-cyano-4-methyl-6-oxo-1H-pyridazin-3-yl)ethenyl]phenoxy]methyl]benzoate Traditional Name: 4-[[2-[(E)-2-(5-cyano-6-keto-4-methyl-1H-pyridazin-3-yl)vinyl]phenoxy]methyl]benzoic acid methyl ester Formula: C23H19N3O4 MolecularWeight: 401.41466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1C=CC2=CC=CC=C2OCC3=CC=C(C=C3)C(=O)OC)C#N

Isomeric SMILES

CC1=C(C(=O)NN=C1/C=C/C2=CC=CC=C2OCC3=CC=C(C=C3)C(=O)OC)C#N

InChI

InChI=1S/C23H19N3O4/c1-15-19(13-24)22(27)26-25-20(15)12-11-17-5-3-4-6-21(17)30-14-16-7-9-18(10-8-16)23(28)29-2/h3-12H,14H2,1-2H3,(H,26,27)/b12-11+