(4E)-4-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[(4-isopentyloxy-3-methoxy-phenyl)methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-(4-isoamoxy-3-methoxy-benzylidene)-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C23H26N2O3 MolecularWeight: 378.46414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OCCC(C)C)OC)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC(=C(C=C2)OCCC(C)C)OC)C3=CC=CC=C3

InChI

InChI=1S/C23H26N2O3/c1-16(2)12-13-28-21-11-10-18(15-22(21)27-4)14-20-17(3)24-25(23(20)26)19-8-6-5-7-9-19/h5-11,14-16H,12-13H2,1-4H3/b20-14+