2-methylsulfonyl-4-oxidanyl-4-(4-phenoxybutyl)-5-[(E)-1,4,7-tris(oxidanyl)hept-2-enyl]cyclopent-2-en-1-one

Systemtic Name: 2-methylsulfonyl-4-oxidanyl-4-(4-phenoxybutyl)-5-[(E)-1,4,7-tris(oxidanyl)hept-2-enyl]cyclopent-2-en-1-one Openeye Name: 4-hydroxy-2-methylsulfonyl-4-(4-phenoxybutyl)-5-[(E)-1,4,7-trihydroxyhept-2-enyl]cyclopent-2-en-1-one CAS Name: 4-hydroxy-2-methylsulfonyl-4-(4-phenoxybutyl)-5-[(E)-1,4,7-trihydroxyhept-2-enyl]-1-cyclopent-2-enone IUPAC Name: 4-hydroxy-2-methylsulfonyl-4-(4-phenoxybutyl)-5-[(E)-1,4,7-trihydroxyhept-2-enyl]cyclopent-2-en-1-one Traditional Name: 4-hydroxy-2-mesyl-4-(4-phenoxybutyl)-5-[(E)-1,4,7-trihydroxyhept-2-enyl]cyclopent-2-en-1-one Formula: C23H32O8S MolecularWeight: 468.56038

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(C(C1=O)C(C=CC(CCCO)O)O)(CCCCOC2=CC=CC=C2)O

Isomeric SMILES

CS(=O)(=O)C1=CC(C(C1=O)C(/C=C/C(CCCO)O)O)(CCCCOC2=CC=CC=C2)O

InChI

InChI=1S/C23H32O8S/c1-32(29,30)20-16-23(28,13-5-6-15-31-18-9-3-2-4-10-18)21(22(20)27)19(26)12-11-17(25)8-7-14-24/h2-4,9-12,16-17,19,21,24-26,28H,5-8,13-15H2,1H3/b12-11+