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

Systemtic Name: 2-butoxy-8-fluoranyl-7-heptoxy-9,10-dihydrophenanthren-1-amine Openeye Name: 2-butoxy-8-fluoro-7-heptoxy-9,10-dihydrophenanthren-1-amine CAS Name: 2-butoxy-8-fluoro-7-heptoxy-9,10-dihydrophenanthren-1-amine IUPAC Name: 2-butoxy-8-fluoro-7-heptoxy-9,10-dihydrophenanthren-1-amine Traditional Name: (2-butoxy-8-fluoro-7-heptoxy-9,10-dihydrophenanthren-1-yl)amine Formula: C25H34FNO2 MolecularWeight: 399.541363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34FNO2/c1-3-5-7-8-9-17-28-22-14-12-18-19-13-15-23(29-16-6-4-2)25(27)21(19)11-10-20(18)24(22)26/h12-15H,3-11,16-17,27H2,1-2H3