4-[3-(4-methoxyphenyl)carbonyl-4-oxidanyl-5-oxidanylidene-1-phenyl-pyrazol-4-yl]-5-(4-methylphenyl)furan-2,3-dione

Systemtic Name: 4-[3-(4-methoxyphenyl)carbonyl-4-oxidanyl-5-oxidanylidene-1-phenyl-pyrazol-4-yl]-5-(4-methylphenyl)furan-2,3-dione Openeye Name: 4-[4-hydroxy-3-(4-methoxybenzoyl)-5-oxo-1-phenyl-pyrazol-4-yl]-5-(p-tolyl)furan-2,3-dione CAS Name: 4-[4-hydroxy-3-[(4-methoxyphenyl)-oxomethyl]-5-oxo-1-phenyl-4-pyrazolyl]-5-(4-methylphenyl)furan-2,3-dione IUPAC Name: 4-[4-hydroxy-3-(4-methoxybenzoyl)-5-oxo-1-phenylpyrazol-4-yl]-5-(4-methylphenyl)furan-2,3-dione Traditional Name: 4-(4-hydroxy-5-keto-3-p-anisoyl-1-phenyl-2-pyrazolin-4-yl)-5-(p-tolyl)furan-2,3-quinone Formula: C28H20N2O7 MolecularWeight: 496.4676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C(=O)O2)C3(C(=NN(C3=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)OC)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C(=O)O2)C3(C(=NN(C3=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)OC)O

InChI

InChI=1S/C28H20N2O7/c1-16-8-10-18(11-9-16)24-21(23(32)26(33)37-24)28(35)25(22(31)17-12-14-20(36-2)15-13-17)29-30(27(28)34)19-6-4-3-5-7-19/h3-15,35H,1-2H3