(4E)-2-(3,4-dichlorophenyl)-4-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]-5-methyl-pyrazol-3-one

Systemtic Name: (4E)-2-(3,4-dichlorophenyl)-4-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]-5-methyl-pyrazol-3-one Openeye Name: (4E)-4-[(4-allyloxy-3-methoxy-phenyl)methylene]-2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-2-(3,4-dichlorophenyl)-4-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-5-methyl-3-pyrazolone IUPAC Name: (4E)-2-(3,4-dichlorophenyl)-4-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-5-methylpyrazol-3-one Traditional Name: (4E)-4-(4-allyloxy-3-methoxy-benzylidene)-2-(3,4-dichlorophenyl)-5-methyl-2-pyrazolin-3-one Formula: C21H18Cl2N2O3 MolecularWeight: 417.28522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OCC=C)OC)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC(=C(C=C2)OCC=C)OC)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H18Cl2N2O3/c1-4-9-28-19-8-5-14(11-20(19)27-3)10-16-13(2)24-25(21(16)26)15-6-7-17(22)18(23)12-15/h4-8,10-12H,1,9H2,2-3H3/b16-10+