(4E)-4-[(3-methoxy-4-phenethyloxy-phenyl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[(3-methoxy-4-phenethyloxy-phenyl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[(3-methoxy-4-phenethyloxy-phenyl)methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[(3-methoxy-4-phenethyloxyphenyl)methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[(3-methoxy-4-phenethyloxyphenyl)methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-(3-methoxy-4-phenethyloxy-benzylidene)-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OCCC3=CC=CC=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC(=C(C=C2)OCCC3=CC=CC=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C26H24N2O3/c1-19-23(26(29)28(27-19)22-11-7-4-8-12-22)17-21-13-14-24(25(18-21)30-2)31-16-15-20-9-5-3-6-10-20/h3-14,17-18H,15-16H2,1-2H3/b23-17+