3-[[6-(4-hydroxyphenyl)sulfonyl-2,2,3-trimethyl-3-oxidanyl-4H-chromen-4-yl]oxy]-1H-pyridazin-6-one

Systemtic Name: 3-[[6-(4-hydroxyphenyl)sulfonyl-2,2,3-trimethyl-3-oxidanyl-4H-chromen-4-yl]oxy]-1H-pyridazin-6-one Openeye Name: 3-[3-hydroxy-6-(4-hydroxyphenyl)sulfonyl-2,2,3-trimethyl-chroman-4-yl]oxy-1H-pyridazin-6-one CAS Name: 3-[[3-hydroxy-6-(4-hydroxyphenyl)sulfonyl-2,2,3-trimethyl-3,4-dihydro-2H-1-benzopyran-4-yl]oxy]-1H-pyridazin-6-one IUPAC Name: 3-[[3-hydroxy-6-(4-hydroxyphenyl)sulfonyl-2,2,3-trimethyl-4H-chromen-4-yl]oxy]-1H-pyridazin-6-one Traditional Name: 3-[3-hydroxy-6-(4-hydroxyphenyl)sulfonyl-2,2,3-trimethyl-chroman-4-yl]oxy-1H-pyridazin-6-one Formula: C22H22N2O7S MolecularWeight: 458.48428

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)S(=O)(=O)C3=CC=C(C=C3)O)OC4=NNC(=O)C=C4)(C)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)S(=O)(=O)C3=CC=C(C=C3)O)OC4=NNC(=O)C=C4)(C)O)C

InChI

InChI=1S/C22H22N2O7S/c1-21(2)22(3,27)20(30-19-11-10-18(26)23-24-19)16-12-15(8-9-17(16)31-21)32(28,29)14-6-4-13(25)5-7-14/h4-12,20,25,27H,1-3H3,(H,23,26)