(5E)-3-methyl-5-[5-(4-methylphenyl)pyrazolidin-3-ylidene]-2-(phenylcarbonyl)-1-benzofuran-6-one

Systemtic Name: (5E)-3-methyl-5-[5-(4-methylphenyl)pyrazolidin-3-ylidene]-2-(phenylcarbonyl)-1-benzofuran-6-one Openeye Name: (5E)-2-benzoyl-3-methyl-5-[5-(p-tolyl)pyrazolidin-3-ylidene]benzofuran-6-one CAS Name: (5E)-2-benzoyl-3-methyl-5-[5-(4-methylphenyl)-3-pyrazolidinylidene]-6-benzofuranone IUPAC Name: (5E)-2-benzoyl-3-methyl-5-[5-(4-methylphenyl)pyrazolidin-3-ylidene]-1-benzofuran-6-one Traditional Name: (5E)-2-benzoyl-3-methyl-5-[5-(p-tolyl)pyrazolidin-3-ylidene]benzofuran-6-one Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=C3C=C4C(=C(OC4=CC3=O)C(=O)C5=CC=CC=C5)C)NN2

Isomeric SMILES

CC1=CC=C(C=C1)C2C/C(=C\3/C=C4C(=C(OC4=CC3=O)C(=O)C5=CC=CC=C5)C)/NN2

InChI

InChI=1S/C26H22N2O3/c1-15-8-10-17(11-9-15)21-13-22(28-27-21)20-12-19-16(2)26(31-24(19)14-23(20)29)25(30)18-6-4-3-5-7-18/h3-12,14,21,27-28H,13H2,1-2H3/b22-20+