4-[2-(5-fluoranyl-2-methyl-phenyl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-(5-fluoranyl-2-methyl-phenyl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(5-fluoro-2-methyl-phenyl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[2-(5-fluoro-2-methylphenyl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-(5-fluoro-2-methylphenyl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[1-(5-fluoro-2-methyl-phenyl)-4,5-bis(4-hydroxyphenyl)-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C28H21FN2O3 MolecularWeight: 452.476343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)N2C(=C(C(=C3C=CC(=O)C=C3)N2)C4=CC=C(C=C4)O)C5=CC=C(C=C5)O

Isomeric SMILES

CC1=C(C=C(C=C1)F)N2C(=C(C(=C3C=CC(=O)C=C3)N2)C4=CC=C(C=C4)O)C5=CC=C(C=C5)O

InChI

InChI=1S/C28H21FN2O3/c1-17-2-9-21(29)16-25(17)31-28(20-7-14-24(34)15-8-20)26(18-3-10-22(32)11-4-18)27(30-31)19-5-12-23(33)13-6-19/h2-16,30,32,34H,1H3