(4E)-4-[(3-ethoxy-4-prop-2-enoxy-phenyl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[(3-ethoxy-4-prop-2-enoxy-phenyl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[(4-allyloxy-3-ethoxy-phenyl)methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[(3-ethoxy-4-prop-2-enoxyphenyl)methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[(3-ethoxy-4-prop-2-enoxyphenyl)methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-(4-allyloxy-3-ethoxy-benzylidene)-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C22H22N2O3 MolecularWeight: 362.42168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=NN(C2=O)C3=CC=CC=C3)C)OCC=C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/2\C(=NN(C2=O)C3=CC=CC=C3)C)OCC=C

InChI

InChI=1S/C22H22N2O3/c1-4-13-27-20-12-11-17(15-21(20)26-5-2)14-19-16(3)23-24(22(19)25)18-9-7-6-8-10-18/h4,6-12,14-15H,1,5,13H2,2-3H3/b19-14+