(4E)-4-[(2,4-dimethoxyphenyl)methylidene]-2-phenyl-5-propyl-pyrazol-3-one

Systemtic Name: (4E)-4-[(2,4-dimethoxyphenyl)methylidene]-2-phenyl-5-propyl-pyrazol-3-one Openeye Name: (4E)-4-[(2,4-dimethoxyphenyl)methylene]-2-phenyl-5-propyl-pyrazol-3-one CAS Name: (4E)-4-[(2,4-dimethoxyphenyl)methylidene]-2-phenyl-5-propyl-3-pyrazolone IUPAC Name: (4E)-4-[(2,4-dimethoxyphenyl)methylidene]-2-phenyl-5-propylpyrazol-3-one Traditional Name: (4E)-4-(2,4-dimethoxybenzylidene)-2-phenyl-5-propyl-2-pyrazolin-3-one Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=CC2=C(C=C(C=C2)OC)OC)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O3/c1-4-8-19-18(13-15-11-12-17(25-2)14-20(15)26-3)21(24)23(22-19)16-9-6-5-7-10-16/h5-7,9-14H,4,8H2,1-3H3/b18-13+