(3E)-6-methoxy-3-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylidene]chromen-4-one

Systemtic Name: (3E)-6-methoxy-3-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylidene]chromen-4-one Openeye Name: (3E)-6-methoxy-3-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methylene]chroman-4-one CAS Name: (3E)-6-methoxy-3-[[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methylidene]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (3E)-6-methoxy-3-[(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methylidene]chromen-4-one Traditional Name: (3E)-6-methoxy-3-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methylene]chroman-4-one Formula: C25H19N3O3 MolecularWeight: 409.43666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCC(=CC3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)C2=O

Isomeric SMILES

COC1=CC2=C(C=C1)OC/C(=C\C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)/C2=O

InChI

InChI=1S/C25H19N3O3/c1-30-21-9-10-23-22(13-21)25(29)19(16-31-23)12-18-15-28(20-7-3-2-4-8-20)27-24(18)17-6-5-11-26-14-17/h2-15H,16H2,1H3/b19-12+