8-fluoranyl-4-[(5R)-5-oxidanylhexoxy]-2-[(5R)-5-oxidanylhexyl]phthalazin-1-one

Systemtic Name: 8-fluoranyl-4-[(5R)-5-oxidanylhexoxy]-2-[(5R)-5-oxidanylhexyl]phthalazin-1-one Openeye Name: 8-fluoro-4-[(5R)-5-hydroxyhexoxy]-2-[(5R)-5-hydroxyhexyl]phthalazin-1-one CAS Name: 8-fluoro-4-[(5R)-5-hydroxyhexoxy]-2-[(5R)-5-hydroxyhexyl]-1-phthalazinone IUPAC Name: 8-fluoro-4-[(5R)-5-hydroxyhexoxy]-2-[(5R)-5-hydroxyhexyl]phthalazin-1-one Traditional Name: 8-fluoro-4-[(5R)-5-hydroxyhexoxy]-2-[(5R)-5-hydroxyhexyl]phthalazin-1-one Formula: C20H29FN2O4 MolecularWeight: 380.453663

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN1C(=O)C2=C(C=CC=C2F)C(=N1)OCCCCC(C)O)O

Isomeric SMILES

C[C@H](CCCCN1C(=O)C2=C(C=CC=C2F)C(=N1)OCCCC[C@@H](C)O)O

InChI

InChI=1S/C20H29FN2O4/c1-14(24)8-3-5-12-23-20(26)18-16(10-7-11-17(18)21)19(22-23)27-13-6-4-9-15(2)25/h7,10-11,14-15,24-25H,3-6,8-9,12-13H2,1-2H3/t14-,15-/m1/s1