2-ethylsulfinyl-8-(1-methyl-3-oxidanyl-piperidin-4-yl)-5,7-bis(oxidanyl)chromen-4-one

Systemtic Name: 2-ethylsulfinyl-8-(1-methyl-3-oxidanyl-piperidin-4-yl)-5,7-bis(oxidanyl)chromen-4-one Openeye Name: 2-ethylsulfinyl-5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidyl)chromen-4-one CAS Name: 2-ethylsulfinyl-5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidinyl)-1-benzopyran-4-one IUPAC Name: 2-ethylsulfinyl-5,7-dihydroxy-8-(3-hydroxy-1-methylpiperidin-4-yl)chromen-4-one Traditional Name: 2-ethylsulfinyl-5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidyl)chromone Formula: C17H21NO6S MolecularWeight: 367.41674

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1=CC(=O)C2=C(O1)C(=C(C=C2O)O)C3CCN(CC3O)C

Isomeric SMILES

CCS(=O)C1=CC(=O)C2=C(O1)C(=C(C=C2O)O)C3CCN(CC3O)C

InChI

InChI=1S/C17H21NO6S/c1-3-25(23)14-7-12(21)16-11(20)6-10(19)15(17(16)24-14)9-4-5-18(2)8-13(9)22/h6-7,9,13,19-20,22H,3-5,8H2,1-2H3