6-butyl-1,5,6-tris(fluoranyl)-3-phenyl-cyclohexa-1,4-diene

Systemtic Name: 6-butyl-1,5,6-tris(fluoranyl)-3-phenyl-cyclohexa-1,4-diene Openeye Name: 6-butyl-1,5,6-trifluoro-3-phenyl-cyclohexa-1,4-diene CAS Name: 6-butyl-1,5,6-trifluoro-3-phenylcyclohexa-1,4-diene IUPAC Name: 6-butyl-1,5,6-trifluoro-3-phenylcyclohexa-1,4-diene Traditional Name: 6-butyl-1,5,6-trifluoro-3-phenyl-cyclohexa-1,4-diene Formula: C16H17F3 MolecularWeight: 266.30139

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=CC(C=C1F)C2=CC=CC=C2)F)F

Isomeric SMILES

CCCCC1(C(=CC(C=C1F)C2=CC=CC=C2)F)F

InChI

InChI=1S/C16H17F3/c1-2-3-9-16(19)14(17)10-13(11-15(16)18)12-7-5-4-6-8-12/h4-8,10-11,13H,2-3,9H2,1H3