2-[(2-methoxyphenyl)-(5-oxidanylidene-3-phenyl-1,4-dihydropyrazol-4-yl)methyl]propanedinitrile

Systemtic Name: 2-[(2-methoxyphenyl)-(5-oxidanylidene-3-phenyl-1,4-dihydropyrazol-4-yl)methyl]propanedinitrile Openeye Name: 2-[(2-methoxyphenyl)-(5-oxo-3-phenyl-1,4-dihydropyrazol-4-yl)methyl]propanedinitrile CAS Name: 2-[(2-methoxyphenyl)-(5-oxo-3-phenyl-1,4-dihydropyrazol-4-yl)methyl]propanedinitrile IUPAC Name: 2-[(2-methoxyphenyl)-(5-oxo-3-phenyl-1,4-dihydropyrazol-4-yl)methyl]propanedinitrile Traditional Name: 2-[(3-keto-5-phenyl-2-pyrazolin-4-yl)-(2-methoxyphenyl)methyl]malononitrile Formula: C20H16N4O2 MolecularWeight: 344.36664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(C2C(=NNC2=O)C3=CC=CC=C3)C(C#N)C#N

Isomeric SMILES

COC1=CC=CC=C1C(C2C(=NNC2=O)C3=CC=CC=C3)C(C#N)C#N

InChI

InChI=1S/C20H16N4O2/c1-26-16-10-6-5-9-15(16)17(14(11-21)12-22)18-19(23-24-20(18)25)13-7-3-2-4-8-13/h2-10,14,17-18H,1H3,(H,24,25)