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

Systemtic Name: 3-[[6-fluoranyl-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromen-4-yl]amino]-1H-pyridazin-6-one Openeye Name: 3-[[6-fluoro-3-hydroxy-2,2-bis(methoxymethyl)chroman-4-yl]amino]-1H-pyridazin-6-one CAS Name: 3-[[6-fluoro-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydro-2H-1-benzopyran-4-yl]amino]-1H-pyridazin-6-one IUPAC Name: 3-[[6-fluoro-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydrochromen-4-yl]amino]-1H-pyridazin-6-one Traditional Name: 3-[[6-fluoro-3-hydroxy-2,2-bis(methoxymethyl)chroman-4-yl]amino]-1H-pyridazin-6-one Formula: C17H20FN3O5 MolecularWeight: 365.356203

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Descriptors Computed from Structure

Canonical SMILES:

COCC1(C(C(C2=C(O1)C=CC(=C2)F)NC3=NNC(=O)C=C3)O)COC

Isomeric SMILES

COCC1(C(C(C2=C(O1)C=CC(=C2)F)NC3=NNC(=O)C=C3)O)COC

InChI

InChI=1S/C17H20FN3O5/c1-24-8-17(9-25-2)16(23)15(19-13-5-6-14(22)21-20-13)11-7-10(18)3-4-12(11)26-17/h3-7,15-16,23H,8-9H2,1-2H3,(H,19,20)(H,21,22)