(4Z)-4-[5-(4-decoxy-3-fluoranyl-phenyl)-1H-pyridin-2-ylidene]-3-fluoranyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-4-[5-(4-decoxy-3-fluoranyl-phenyl)-1H-pyridin-2-ylidene]-3-fluoranyl-cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-4-[5-(4-decoxy-3-fluoro-phenyl)-1H-pyridin-2-ylidene]-3-fluoro-cyclohexa-2,5-dien-1-one CAS Name: (4Z)-4-[5-(4-decoxy-3-fluorophenyl)-1H-pyridin-2-ylidene]-3-fluoro-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-4-[5-(4-decoxy-3-fluorophenyl)-1H-pyridin-2-ylidene]-3-fluorocyclohexa-2,5-dien-1-one Traditional Name: (4Z)-4-[5-(4-decoxy-3-fluoro-phenyl)-1H-pyridin-2-ylidene]-3-fluoro-cyclohexa-2,5-dien-1-one Formula: C27H31F2NO2 MolecularWeight: 439.537346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)C2=CNC(=C3C=CC(=O)C=C3F)C=C2)F

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)C2=CN/C(=C\3/C=CC(=O)C=C3F)/C=C2)F

InChI

InChI=1S/C27H31F2NO2/c1-2-3-4-5-6-7-8-9-16-32-27-15-11-20(17-25(27)29)21-10-14-26(30-19-21)23-13-12-22(31)18-24(23)28/h10-15,17-19,30H,2-9,16H2,1H3/b26-23-