3-fluoranyl-5-[2-[6-(phenethylamino)hexylamino]ethyl]benzene-1,2-diol

Systemtic Name: 3-fluoranyl-5-[2-[6-(phenethylamino)hexylamino]ethyl]benzene-1,2-diol Openeye Name: 3-fluoro-5-[2-[6-(phenethylamino)hexylamino]ethyl]benzene-1,2-diol CAS Name: 3-fluoro-5-[2-[6-(phenethylamino)hexylamino]ethyl]benzene-1,2-diol IUPAC Name: 3-fluoro-5-[2-[6-(phenethylamino)hexylamino]ethyl]benzene-1,2-diol Traditional Name: 3-fluoro-5-[2-[6-(phenethylamino)hexylamino]ethyl]pyrocatechol Formula: C22H31FN2O2 MolecularWeight: 374.492143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCCCCCCNCCC2=CC(=C(C(=C2)F)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCNCCCCCCNCCC2=CC(=C(C(=C2)F)O)O

InChI

InChI=1S/C22H31FN2O2/c23-20-16-19(17-21(26)22(20)27)11-15-25-13-7-2-1-6-12-24-14-10-18-8-4-3-5-9-18/h3-5,8-9,16-17,24-27H,1-2,6-7,10-15H2