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

Systemtic Name: (4E)-4-[(3-methoxy-2-propan-2-yloxy-phenyl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[(2-isopropoxy-3-methoxy-phenyl)methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[(3-methoxy-2-propan-2-yloxyphenyl)methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[(3-methoxy-2-propan-2-yloxyphenyl)methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-(2-isopropoxy-3-methoxy-benzylidene)-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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