4-[(3-methyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[(3-methyl-4-pyrrolidin-1-yl-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[(3-methyl-4-pyrrolidin-1-yl-phenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[3-methyl-4-(1-pyrrolidinyl)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[(3-methyl-4-pyrrolidin-1-ylphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(3-methyl-4-pyrrolidino-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C21H21N3O2 MolecularWeight: 347.41034

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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)N4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C21H21N3O2/c1-15-13-16(9-10-19(15)23-11-5-6-12-23)14-18-20(25)22-24(21(18)26)17-7-3-2-4-8-17/h2-4,7-10,13-14H,5-6,11-12H2,1H3,(H,22,25)