1,2-bis(fluoranyl)-3-octoxy-3-pentyl-6-phenyl-cyclohexa-1,4-diene

Systemtic Name: 1,2-bis(fluoranyl)-3-octoxy-3-pentyl-6-phenyl-cyclohexa-1,4-diene Openeye Name: 1,2-difluoro-3-octoxy-3-pentyl-6-phenyl-cyclohexa-1,4-diene CAS Name: 1,2-difluoro-3-octoxy-3-pentyl-6-phenylcyclohexa-1,4-diene IUPAC Name: 1,2-difluoro-3-octoxy-3-pentyl-6-phenylcyclohexa-1,4-diene Traditional Name: 3-amyl-1,2-difluoro-3-octoxy-6-phenyl-cyclohexa-1,4-diene Formula: C25H36F2O MolecularWeight: 390.549546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1(C=CC(C(=C1F)F)C2=CC=CC=C2)CCCCC

Isomeric SMILES

CCCCCCCCOC1(C=CC(C(=C1F)F)C2=CC=CC=C2)CCCCC

InChI

InChI=1S/C25H36F2O/c1-3-5-7-8-9-14-20-28-25(18-13-6-4-2)19-17-22(23(26)24(25)27)21-15-11-10-12-16-21/h10-12,15-17,19,22H,3-9,13-14,18,20H2,1-2H3