2-[[1-phenyl-3-(3,4,5-trimethoxyphenyl)pyrazol-4-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[1-phenyl-3-(3,4,5-trimethoxyphenyl)pyrazol-4-yl]methylidene]propanedinitrile Openeye Name: 2-[[1-phenyl-3-(3,4,5-trimethoxyphenyl)pyrazol-4-yl]methylene]propanedinitrile CAS Name: 2-[[1-phenyl-3-(3,4,5-trimethoxyphenyl)-4-pyrazolyl]methylidene]propanedinitrile IUPAC Name: 2-[[1-phenyl-3-(3,4,5-trimethoxyphenyl)pyrazol-4-yl]methylidene]propanedinitrile Traditional Name: 2-[[1-phenyl-3-(3,4,5-trimethoxyphenyl)pyrazol-4-yl]methylene]malononitrile Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN(C=C2C=C(C#N)C#N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN(C=C2C=C(C#N)C#N)C3=CC=CC=C3

InChI

InChI=1S/C22H18N4O3/c1-27-19-10-16(11-20(28-2)22(19)29-3)21-17(9-15(12-23)13-24)14-26(25-21)18-7-5-4-6-8-18/h4-11,14H,1-3H3