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

Systemtic Name: 4-[2-(3-chloranyl-4-fluoranyl-phenyl)-3-(4-hydroxyphenyl)-4-phenyl-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(3-chloro-4-fluoro-phenyl)-3-(4-hydroxyphenyl)-4-phenyl-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[2-(3-chloro-4-fluorophenyl)-3-(4-hydroxyphenyl)-4-phenyl-1H-pyrazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-(3-chloro-4-fluorophenyl)-3-(4-hydroxyphenyl)-4-phenyl-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[1-(3-chloro-4-fluoro-phenyl)-5-(4-hydroxyphenyl)-4-phenyl-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C27H18ClFN2O2 MolecularWeight: 456.895423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(NC2=C3C=CC(=O)C=C3)C4=CC(=C(C=C4)F)Cl)C5=CC=C(C=C5)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(NC2=C3C=CC(=O)C=C3)C4=CC(=C(C=C4)F)Cl)C5=CC=C(C=C5)O

InChI

InChI=1S/C27H18ClFN2O2/c28-23-16-20(10-15-24(23)29)31-27(19-8-13-22(33)14-9-19)25(17-4-2-1-3-5-17)26(30-31)18-6-11-21(32)12-7-18/h1-16,30,33H