[(2R)-6-[8-fluoranyl-4-[(5R)-5-oxidanylhexoxy]-1-oxidanylidene-phthalazin-2-yl]hexan-2-yl] ethanoate

Systemtic Name: [(2R)-6-[8-fluoranyl-4-[(5R)-5-oxidanylhexoxy]-1-oxidanylidene-phthalazin-2-yl]hexan-2-yl] ethanoate Openeye Name: [(1R)-5-[8-fluoro-4-[(5R)-5-hydroxyhexoxy]-1-oxo-phthalazin-2-yl]-1-methyl-pentyl] acetate CAS Name: acetic acid [(2R)-6-[8-fluoro-4-[(5R)-5-hydroxyhexoxy]-1-oxo-2-phthalazinyl]hexan-2-yl] ester IUPAC Name: [(2R)-6-[8-fluoro-4-[(5R)-5-hydroxyhexoxy]-1-oxophthalazin-2-yl]hexan-2-yl] acetate Traditional Name: acetic acid [(1R)-5-[8-fluoro-4-[(5R)-5-hydroxyhexoxy]-1-keto-phthalazin-2-yl]-1-methyl-pentyl] ester Formula: C22H31FN2O5 MolecularWeight: 422.490343

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCOC1=NN(C(=O)C2=C1C=CC=C2F)CCCCC(C)OC(=O)C)O

Isomeric SMILES

C[C@H](CCCCOC1=NN(C(=O)C2=C1C=CC=C2F)CCCC[C@@H](C)OC(=O)C)O

InChI

InChI=1S/C22H31FN2O5/c1-15(26)9-5-7-14-29-21-18-11-8-12-19(23)20(18)22(28)25(24-21)13-6-4-10-16(2)30-17(3)27/h8,11-12,15-16,26H,4-7,9-10,13-14H2,1-3H3/t15-,16-/m1/s1