(4E)-4-[[4-(cyclopropylmethoxy)-3-methyl-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: (4E)-4-[[4-(cyclopropylmethoxy)-3-methyl-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: (4E)-4-[[4-(cyclopropylmethoxy)-3-methyl-phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: (4E)-4-[[4-(cyclopropylmethoxy)-3-methylphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: (4E)-4-[[4-(cyclopropylmethoxy)-3-methylphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: (4E)-4-[4-(cyclopropylmethoxy)-3-methyl-benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OCC4CC4

Isomeric SMILES

CC1=C(C=CC(=C1)/C=C/2\C(=O)NN(C2=O)C3=CC=CC=C3)OCC4CC4

InChI

InChI=1S/C21H20N2O3/c1-14-11-16(9-10-19(14)26-13-15-7-8-15)12-18-20(24)22-23(21(18)25)17-5-3-2-4-6-17/h2-6,9-12,15H,7-8,13H2,1H3,(H,22,24)/b18-12+