(4Z)-4-[[5-(hydroxymethyl)furan-2-yl]methylidene]-2-phenyl-5-(phenylmethyl)pyrazol-3-one

Systemtic Name: (4Z)-4-[[5-(hydroxymethyl)furan-2-yl]methylidene]-2-phenyl-5-(phenylmethyl)pyrazol-3-one Openeye Name: (4Z)-5-benzyl-4-[[5-(hydroxymethyl)-2-furyl]methylene]-2-phenyl-pyrazol-3-one CAS Name: (4Z)-4-[[5-(hydroxymethyl)-2-furanyl]methylidene]-2-phenyl-5-(phenylmethyl)-3-pyrazolone IUPAC Name: (4Z)-5-benzyl-4-[[5-(hydroxymethyl)furan-2-yl]methylidene]-2-phenylpyrazol-3-one Traditional Name: (4Z)-5-benzyl-4-[(5-methylol-2-furyl)methylene]-2-phenyl-2-pyrazolin-3-one Formula: C22H18N2O3 MolecularWeight: 358.38992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN(C(=O)C2=CC3=CC=C(O3)CO)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC\2=NN(C(=O)/C2=C\C3=CC=C(O3)CO)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O3/c25-15-19-12-11-18(27-19)14-20-21(13-16-7-3-1-4-8-16)23-24(22(20)26)17-9-5-2-6-10-17/h1-12,14,25H,13,15H2/b20-14-