4,5-bis(oxidanyl)-2-[1-[4-(propylsulfonylmethyl)phenyl]but-3-ynyl]furan-3-one

Systemtic Name: 4,5-bis(oxidanyl)-2-[1-[4-(propylsulfonylmethyl)phenyl]but-3-ynyl]furan-3-one Openeye Name: 4,5-dihydroxy-2-[1-[4-(propylsulfonylmethyl)phenyl]but-3-ynyl]furan-3-one CAS Name: 4,5-dihydroxy-2-[1-[4-(propylsulfonylmethyl)phenyl]but-3-ynyl]-3-furanone IUPAC Name: 4,5-dihydroxy-2-[1-[4-(propylsulfonylmethyl)phenyl]but-3-ynyl]furan-3-one Traditional Name: 4,5-dihydroxy-2-[1-[4-(propylsulfonylmethyl)phenyl]but-3-ynyl]furan-3-one Formula: C18H20O6S MolecularWeight: 364.4128

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)CC1=CC=C(C=C1)C(CC#C)C2C(=O)C(=C(O2)O)O

Isomeric SMILES

CCCS(=O)(=O)CC1=CC=C(C=C1)C(CC#C)C2C(=O)C(=C(O2)O)O

InChI

InChI=1S/C18H20O6S/c1-3-5-14(17-15(19)16(20)18(21)24-17)13-8-6-12(7-9-13)11-25(22,23)10-4-2/h1,6-9,14,17,20-21H,4-5,10-11H2,2H3