2,3-dimethoxy-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-3-oxidanyl-chromen-4-one

Systemtic Name: 2,3-dimethoxy-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]-3-oxidanyl-chromen-4-one Openeye Name: 3-hydroxy-2,3-dimethoxy-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]chroman-4-one CAS Name: 3-hydroxy-2,3-dimethoxy-2-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 3-hydroxy-2,3-dimethoxy-2-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]chromen-4-one Traditional Name: 3-hydroxy-2,3-dimethoxy-2-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]chroman-4-one Formula: C26H21N3O7 MolecularWeight: 487.46084

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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=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C26H21N3O7/c1-34-25(31)24(30)20-10-6-7-11-22(20)36-26(25,35-2)21-16-28(18-8-4-3-5-9-18)27-23(21)17-12-14-19(15-13-17)29(32)33/h3-16,31H,1-2H3