7-butoxy-1-fluoranyl-2-nonoxy-phenanthrene

Systemtic Name: 7-butoxy-1-fluoranyl-2-nonoxy-phenanthrene Openeye Name: 7-butoxy-1-fluoro-2-nonoxy-phenanthrene CAS Name: 7-butoxy-1-fluoro-2-nonoxyphenanthrene IUPAC Name: 7-butoxy-1-fluoro-2-nonoxyphenanthrene Traditional Name: 7-butoxy-1-fluoro-2-nonoxy-phenanthrene Formula: C27H35FO2 MolecularWeight: 410.564003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=C(C2=C(C=C1)C3=C(C=C2)C=C(C=C3)OCCCC)F

Isomeric SMILES

CCCCCCCCCOC1=C(C2=C(C=C1)C3=C(C=C2)C=C(C=C3)OCCCC)F

InChI

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