(4E)-4-[(2-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one

Systemtic Name: (4E)-4-[(2-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Openeye Name: (4E)-4-[(2-bromo-4-isopropoxy-5-methoxy-phenyl)methylene]-5-methyl-2-(p-tolyl)pyrazol-3-one CAS Name: (4E)-4-[(2-bromo-5-methoxy-4-propan-2-yloxyphenyl)methylidene]-5-methyl-2-(4-methylphenyl)-3-pyrazolone IUPAC Name: (4E)-4-[(2-bromo-5-methoxy-4-propan-2-yloxyphenyl)methylidene]-5-methyl-2-(4-methylphenyl)pyrazol-3-one Traditional Name: (4E)-4-(2-bromo-4-isopropoxy-5-methoxy-benzylidene)-5-methyl-2-(p-tolyl)-2-pyrazolin-3-one Formula: C22H23BrN2O3 MolecularWeight: 443.33362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3Br)OC(C)C)OC)C(=N2)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC(=C(C=C3Br)OC(C)C)OC)/C(=N2)C

InChI

InChI=1S/C22H23BrN2O3/c1-13(2)28-21-12-19(23)16(11-20(21)27-5)10-18-15(4)24-25(22(18)26)17-8-6-14(3)7-9-17/h6-13H,1-5H3/b18-10+