(2Z)-5,6-dimethyl-2-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylidene]-1-benzofuran-3-one

Systemtic Name: (2Z)-5,6-dimethyl-2-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylidene]-1-benzofuran-3-one Openeye Name: (2Z)-5,6-dimethyl-2-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylene]benzofuran-3-one CAS Name: (2Z)-5,6-dimethyl-2-[[1-phenyl-3-(4-propoxyphenyl)-4-pyrazolyl]methylidene]-3-benzofuranone IUPAC Name: (2Z)-5,6-dimethyl-2-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-5,6-dimethyl-2-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylene]coumaran-3-one Formula: C29H26N2O3 MolecularWeight: 450.52834

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)C4=CC(=C(C=C4O3)C)C)C5=CC=CC=C5

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NN(C=C2/C=C\3/C(=O)C4=CC(=C(C=C4O3)C)C)C5=CC=CC=C5

InChI

InChI=1S/C29H26N2O3/c1-4-14-33-24-12-10-21(11-13-24)28-22(18-31(30-28)23-8-6-5-7-9-23)17-27-29(32)25-15-19(2)20(3)16-26(25)34-27/h5-13,15-18H,4,14H2,1-3H3/b27-17-