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

Systemtic Name: (4E)-4-[(3-chloranyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]-5-methyl-2-(3-methylphenyl)pyrazol-3-one Openeye Name: (4E)-4-[(4-benzyloxy-3-chloro-5-methoxy-phenyl)methylene]-5-methyl-2-(m-tolyl)pyrazol-3-one CAS Name: (4E)-4-[(3-chloro-5-methoxy-4-phenylmethoxyphenyl)methylidene]-5-methyl-2-(3-methylphenyl)-3-pyrazolone IUPAC Name: (4E)-4-[(3-chloro-5-methoxy-4-phenylmethoxyphenyl)methylidene]-5-methyl-2-(3-methylphenyl)pyrazol-3-one Traditional Name: (4E)-4-(4-benzoxy-3-chloro-5-methoxy-benzylidene)-5-methyl-2-(m-tolyl)-2-pyrazolin-3-one Formula: C26H23ClN2O3 MolecularWeight: 446.92542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23ClN2O3/c1-17-8-7-11-21(12-17)29-26(30)22(18(2)28-29)13-20-14-23(27)25(24(15-20)31-3)32-16-19-9-5-4-6-10-19/h4-15H,16H2,1-3H3/b22-13+