2-(1,3-diphenylpyrazol-4-yl)-2,3-dimethoxy-3-oxidanyl-chromen-4-one

Systemtic Name: 2-(1,3-diphenylpyrazol-4-yl)-2,3-dimethoxy-3-oxidanyl-chromen-4-one Openeye Name: 2-(1,3-diphenylpyrazol-4-yl)-3-hydroxy-2,3-dimethoxy-chroman-4-one CAS Name: 2-(1,3-diphenyl-4-pyrazolyl)-3-hydroxy-2,3-dimethoxy-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 2-(1,3-diphenylpyrazol-4-yl)-3-hydroxy-2,3-dimethoxychromen-4-one Traditional Name: 2-(1,3-diphenylpyrazol-4-yl)-3-hydroxy-2,3-dimethoxy-chroman-4-one Formula: C26H22N2O5 MolecularWeight: 442.46328

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C(C(=O)C2=CC=CC=C2O1)(O)OC)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1(C(C(=O)C2=CC=CC=C2O1)(O)OC)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H22N2O5/c1-31-25(30)24(29)20-15-9-10-16-22(20)33-26(25,32-2)21-17-28(19-13-7-4-8-14-19)27-23(21)18-11-5-3-6-12-18/h3-17,30H,1-2H3