(E)-2-cyano-N-methyl-3-[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-methyl-3-[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-3-[3-(4-allyloxyphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-methyl-prop-2-enamide CAS Name: (E)-2-cyano-N-methyl-3-[1-phenyl-3-(4-prop-2-enoxyphenyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-methyl-3-[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]prop-2-enamide Traditional Name: (E)-3-[3-(4-allyloxyphenyl)-1-phenyl-pyrazol-4-yl]-2-cyano-N-methyl-acrylamide Formula: C23H20N4O2 MolecularWeight: 384.4305

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(=CC1=CN(N=C1C2=CC=C(C=C2)OCC=C)C3=CC=CC=C3)C#N

Isomeric SMILES

CNC(=O)/C(=C/C1=CN(N=C1C2=CC=C(C=C2)OCC=C)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C23H20N4O2/c1-3-13-29-21-11-9-17(10-12-21)22-19(14-18(15-24)23(28)25-2)16-27(26-22)20-7-5-4-6-8-20/h3-12,14,16H,1,13H2,2H3,(H,25,28)/b18-14+