3-[[5-(4-bromophenyl)-1H-pyrazol-4-yl]-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]-2-oxidanyl-chromen-4-one

Systemtic Name: 3-[[5-(4-bromophenyl)-1H-pyrazol-4-yl]-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]-2-oxidanyl-chromen-4-one Openeye Name: 3-[[5-(4-bromophenyl)-1H-pyrazol-4-yl]-(2-hydroxy-4-oxo-chromen-3-yl)methyl]-2-hydroxy-chromen-4-one CAS Name: 3-[[5-(4-bromophenyl)-1H-pyrazol-4-yl]-(2-hydroxy-4-oxo-1-benzopyran-3-yl)methyl]-2-hydroxy-1-benzopyran-4-one IUPAC Name: 3-[[5-(4-bromophenyl)-1H-pyrazol-4-yl]-(2-hydroxy-4-oxochromen-3-yl)methyl]-2-hydroxychromen-4-one Traditional Name: 3-[[5-(4-bromophenyl)-1H-pyrazol-4-yl]-(2-hydroxy-4-keto-chromen-3-yl)methyl]-2-hydroxy-chromone Formula: C28H17BrN2O6 MolecularWeight: 557.34838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(O2)O)C(C3=C(NN=C3)C4=CC=C(C=C4)Br)C5=C(OC6=CC=CC=C6C5=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(O2)O)C(C3=C(NN=C3)C4=CC=C(C=C4)Br)C5=C(OC6=CC=CC=C6C5=O)O

InChI

InChI=1S/C28H17BrN2O6/c29-15-11-9-14(10-12-15)24-18(13-30-31-24)21(22-25(32)16-5-1-3-7-19(16)36-27(22)34)23-26(33)17-6-2-4-8-20(17)37-28(23)35/h1-13,21,34-35H,(H,30,31)