4-[[6-fluoranyl-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromen-4-yl]amino]-2-methyl-phthalazin-1-one

Systemtic Name: 4-[[6-fluoranyl-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromen-4-yl]amino]-2-methyl-phthalazin-1-one Openeye Name: 4-[[6-fluoro-3-hydroxy-2,2-bis(methoxymethyl)chroman-4-yl]amino]-2-methyl-phthalazin-1-one CAS Name: 4-[[6-fluoro-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydro-2H-1-benzopyran-4-yl]amino]-2-methyl-1-phthalazinone IUPAC Name: 4-[[6-fluoro-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydrochromen-4-yl]amino]-2-methylphthalazin-1-one Traditional Name: 4-[[6-fluoro-3-hydroxy-2,2-bis(methoxymethyl)chroman-4-yl]amino]-2-methyl-phthalazin-1-one Formula: C22H24FN3O5 MolecularWeight: 429.441463

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)NC3C(C(OC4=C3C=C(C=C4)F)(COC)COC)O

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)NC3C(C(OC4=C3C=C(C=C4)F)(COC)COC)O

InChI

InChI=1S/C22H24FN3O5/c1-26-21(28)15-7-5-4-6-14(15)20(25-26)24-18-16-10-13(23)8-9-17(16)31-22(11-29-2,12-30-3)19(18)27/h4-10,18-19,27H,11-12H2,1-3H3,(H,24,25)