8-fluoranyl-2-heptoxy-3-(7-methyloctoxy)-9,10-dihydrophenanthren-1-amine

Systemtic Name: 8-fluoranyl-2-heptoxy-3-(7-methyloctoxy)-9,10-dihydrophenanthren-1-amine Openeye Name: 8-fluoro-2-heptoxy-3-(7-methyloctoxy)-9,10-dihydrophenanthren-1-amine CAS Name: 8-fluoro-2-heptoxy-3-(7-methyloctoxy)-9,10-dihydrophenanthren-1-amine IUPAC Name: 8-fluoro-2-heptoxy-3-(7-methyloctoxy)-9,10-dihydrophenanthren-1-amine Traditional Name: [8-fluoro-2-heptoxy-3-(7-methyloctoxy)-9,10-dihydrophenanthren-1-yl]amine Formula: C30H44FNO2 MolecularWeight: 469.674263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C2C(=C1N)CCC3=C2C=CC=C3F)OCCCCCCC(C)C

Isomeric SMILES

CCCCCCCOC1=C(C=C2C(=C1N)CCC3=C2C=CC=C3F)OCCCCCCC(C)C

InChI

InChI=1S/C30H44FNO2/c1-4-5-6-8-12-20-34-30-28(33-19-11-9-7-10-14-22(2)3)21-26-23-15-13-16-27(31)24(23)17-18-25(26)29(30)32/h13,15-16,21-22H,4-12,14,17-20,32H2,1-3H3