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

Systemtic Name: 2,3-dimethoxy-2-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]-3-oxidanyl-chromen-4-one Openeye Name: 3-hydroxy-2,3-dimethoxy-2-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]chroman-4-one CAS Name: 3-hydroxy-2,3-dimethoxy-2-[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 3-hydroxy-2,3-dimethoxy-2-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]chromen-4-one Traditional Name: 3-hydroxy-2,3-dimethoxy-2-[1-phenyl-3-(p-tolyl)pyrazol-4-yl]chroman-4-one Formula: C27H24N2O5 MolecularWeight: 456.48986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C3(C(C(=O)C4=CC=CC=C4O3)(O)OC)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C3(C(C(=O)C4=CC=CC=C4O3)(O)OC)OC)C5=CC=CC=C5

InChI

InChI=1S/C27H24N2O5/c1-18-13-15-19(16-14-18)24-22(17-29(28-24)20-9-5-4-6-10-20)27(33-3)26(31,32-2)25(30)21-11-7-8-12-23(21)34-27/h4-17,31H,1-3H3