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

Systemtic Name: (4E)-2-(3,4-dimethylphenyl)-4-[(3-methoxy-4-phenylmethoxy-phenyl)methylidene]-5-methyl-pyrazol-3-one Openeye Name: (4E)-4-[(4-benzyloxy-3-methoxy-phenyl)methylene]-2-(3,4-dimethylphenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-2-(3,4-dimethylphenyl)-4-[(3-methoxy-4-phenylmethoxyphenyl)methylidene]-5-methyl-3-pyrazolone IUPAC Name: (4E)-2-(3,4-dimethylphenyl)-4-[(3-methoxy-4-phenylmethoxyphenyl)methylidene]-5-methylpyrazol-3-one Traditional Name: (4E)-4-(4-benzoxy-3-methoxy-benzylidene)-2-(3,4-dimethylphenyl)-5-methyl-2-pyrazolin-3-one Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)C(=N2)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)/C(=C/C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)/C(=N2)C)C

InChI

InChI=1S/C27H26N2O3/c1-18-10-12-23(14-19(18)2)29-27(30)24(20(3)28-29)15-22-11-13-25(26(16-22)31-4)32-17-21-8-6-5-7-9-21/h5-16H,17H2,1-4H3/b24-15+