2-butoxy-1-fluoranyl-7-octoxy-phenanthrene

Systemtic Name: 2-butoxy-1-fluoranyl-7-octoxy-phenanthrene Openeye Name: 2-butoxy-1-fluoro-7-octoxy-phenanthrene CAS Name: 2-butoxy-1-fluoro-7-octoxyphenanthrene IUPAC Name: 2-butoxy-1-fluoro-7-octoxyphenanthrene Traditional Name: 2-butoxy-1-fluoro-7-octoxy-phenanthrene Formula: C26H33FO2 MolecularWeight: 396.537423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC2=C(C=C1)C3=C(C=C2)C(=C(C=C3)OCCCC)F

Isomeric SMILES

CCCCCCCCOC1=CC2=C(C=C1)C3=C(C=C2)C(=C(C=C3)OCCCC)F

InChI

InChI=1S/C26H33FO2/c1-3-5-7-8-9-10-18-28-21-12-14-22-20(19-21)11-13-24-23(22)15-16-25(26(24)27)29-17-6-4-2/h11-16,19H,3-10,17-18H2,1-2H3