4-[[3-ethoxy-4-[(3-methylphenyl)methoxy]-5-prop-2-enyl-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[[3-ethoxy-4-[(3-methylphenyl)methoxy]-5-prop-2-enyl-phenyl]methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[[3-allyl-5-ethoxy-4-(m-tolylmethoxy)phenyl]methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[[3-ethoxy-4-[(3-methylphenyl)methoxy]-5-prop-2-enylphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[[3-ethoxy-4-[(3-methylphenyl)methoxy]-5-prop-2-enylphenyl]methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-[3-allyl-5-ethoxy-4-(3-methylbenzyl)oxy-benzylidene]-1-phenyl-pyrazolidine-3,5-quinone Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC=CC(=C2)C)CC=C)C=C3C(=O)NN(C3=O)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC=CC(=C2)C)CC=C)C=C3C(=O)NN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C29H28N2O4/c1-4-10-23-16-22(17-25-28(32)30-31(29(25)33)24-13-7-6-8-14-24)18-26(34-5-2)27(23)35-19-21-12-9-11-20(3)15-21/h4,6-9,11-18H,1,5,10,19H2,2-3H3,(H,30,32)