4-[[4-(dimethylamino)-2-prop-2-ynoxy-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[4-(dimethylamino)-2-prop-2-ynoxy-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[4-(dimethylamino)-2-prop-2-ynoxy-phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[4-(dimethylamino)-2-prop-2-ynoxyphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[4-(dimethylamino)-2-prop-2-ynoxyphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-[4-(dimethylamino)-2-propargyloxy-benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OCC#C

Isomeric SMILES

CN(C)C1=CC(=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OCC#C

InChI

InChI=1S/C21H19N3O3/c1-4-12-27-19-14-17(23(2)3)11-10-15(19)13-18-20(25)22-24(21(18)26)16-8-6-5-7-9-16/h1,5-11,13-14H,12H2,2-3H3,(H,22,25)