1-fluoranyl-7-heptoxy-2-hexoxy-phenanthrene

Systemtic Name: 1-fluoranyl-7-heptoxy-2-hexoxy-phenanthrene Openeye Name: 1-fluoro-7-heptoxy-2-hexoxy-phenanthrene CAS Name: 1-fluoro-7-heptoxy-2-hexoxyphenanthrene IUPAC Name: 1-fluoro-7-heptoxy-2-hexoxyphenanthrene Traditional Name: 1-fluoro-7-heptoxy-2-hexoxy-phenanthrene Formula: C27H35FO2 MolecularWeight: 410.564003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC2=C(C=C1)C3=C(C=C2)C(=C(C=C3)OCCCCCC)F

Isomeric SMILES

CCCCCCCOC1=CC2=C(C=C1)C3=C(C=C2)C(=C(C=C3)OCCCCCC)F

InChI

InChI=1S/C27H35FO2/c1-3-5-7-9-11-18-29-22-13-15-23-21(20-22)12-14-25-24(23)16-17-26(27(25)28)30-19-10-8-6-4-2/h12-17,20H,3-11,18-19H2,1-2H3