8-fluoranyl-2-heptoxy-7-pentoxy-9,10-dihydrophenanthren-1-amine

Systemtic Name: 8-fluoranyl-2-heptoxy-7-pentoxy-9,10-dihydrophenanthren-1-amine Openeye Name: 8-fluoro-2-heptoxy-7-pentoxy-9,10-dihydrophenanthren-1-amine CAS Name: 8-fluoro-2-heptoxy-7-pentoxy-9,10-dihydrophenanthren-1-amine IUPAC Name: 8-fluoro-2-heptoxy-7-pentoxy-9,10-dihydrophenanthren-1-amine Traditional Name: (7-amoxy-8-fluoro-2-heptoxy-9,10-dihydrophenanthren-1-yl)amine Formula: C26H36FNO2 MolecularWeight: 413.567943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C2=C(C=C1)C3=C(CC2)C(=C(C=C3)OCCCCC)F)N

Isomeric SMILES

CCCCCCCOC1=C(C2=C(C=C1)C3=C(CC2)C(=C(C=C3)OCCCCC)F)N

InChI

InChI=1S/C26H36FNO2/c1-3-5-7-8-10-18-30-24-16-14-20-19-13-15-23(29-17-9-6-4-2)25(27)21(19)11-12-22(20)26(24)28/h13-16H,3-12,17-18,28H2,1-2H3