(4E)-5-methyl-2-(2-methylphenyl)-4-[(4-phenylmethoxyphenyl)methylidene]pyrazol-3-one

Systemtic Name: (4E)-5-methyl-2-(2-methylphenyl)-4-[(4-phenylmethoxyphenyl)methylidene]pyrazol-3-one Openeye Name: (4E)-4-[(4-benzyloxyphenyl)methylene]-5-methyl-2-(o-tolyl)pyrazol-3-one CAS Name: (4E)-5-methyl-2-(2-methylphenyl)-4-[(4-phenylmethoxyphenyl)methylidene]-3-pyrazolone IUPAC Name: (4E)-5-methyl-2-(2-methylphenyl)-4-[(4-phenylmethoxyphenyl)methylidene]pyrazol-3-one Traditional Name: (4E)-4-(4-benzoxybenzylidene)-5-methyl-2-(o-tolyl)-2-pyrazolin-3-one Formula: C25H22N2O2 MolecularWeight: 382.45438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=CC3=CC=C(C=C3)OCC4=CC=CC=C4)C(=N2)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)/C(=C/C3=CC=C(C=C3)OCC4=CC=CC=C4)/C(=N2)C

InChI

InChI=1S/C25H22N2O2/c1-18-8-6-7-11-24(18)27-25(28)23(19(2)26-27)16-20-12-14-22(15-13-20)29-17-21-9-4-3-5-10-21/h3-16H,17H2,1-2H3/b23-16+