(3E)-6-bromanyl-3-[(1-phenylpyrazol-4-yl)methylidene]chromen-4-one

Systemtic Name: (3E)-6-bromanyl-3-[(1-phenylpyrazol-4-yl)methylidene]chromen-4-one Openeye Name: (3E)-6-bromo-3-[(1-phenylpyrazol-4-yl)methylene]chroman-4-one CAS Name: (3E)-6-bromo-3-[(1-phenyl-4-pyrazolyl)methylidene]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (3E)-6-bromo-3-[(1-phenylpyrazol-4-yl)methylidene]chromen-4-one Traditional Name: (3E)-6-bromo-3-[(1-phenylpyrazol-4-yl)methylene]chroman-4-one Formula: C19H13BrN2O2 MolecularWeight: 381.22272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CN(N=C2)C3=CC=CC=C3)C(=O)C4=C(O1)C=CC(=C4)Br

Isomeric SMILES

C1/C(=C\C2=CN(N=C2)C3=CC=CC=C3)/C(=O)C4=C(O1)C=CC(=C4)Br

InChI

InChI=1S/C19H13BrN2O2/c20-15-6-7-18-17(9-15)19(23)14(12-24-18)8-13-10-21-22(11-13)16-4-2-1-3-5-16/h1-11H,12H2/b14-8+