4-[2-(5-chloranyl-2-oxidanyl-phenyl)-1,3-dithian-2-yl]-4-oxidanyl-2,3-di(propan-2-yloxy)cyclobut-2-en-1-one

Systemtic Name: 4-[2-(5-chloranyl-2-oxidanyl-phenyl)-1,3-dithian-2-yl]-4-oxidanyl-2,3-di(propan-2-yloxy)cyclobut-2-en-1-one Openeye Name: 4-[2-(5-chloro-2-hydroxy-phenyl)-1,3-dithian-2-yl]-4-hydroxy-2,3-diisopropoxy-cyclobut-2-en-1-one CAS Name: 4-[2-(5-chloro-2-hydroxyphenyl)-1,3-dithian-2-yl]-4-hydroxy-2,3-di(propan-2-yloxy)-1-cyclobut-2-enone IUPAC Name: 4-[2-(5-chloro-2-hydroxyphenyl)-1,3-dithian-2-yl]-4-hydroxy-2,3-di(propan-2-yloxy)cyclobut-2-en-1-one Traditional Name: 4-[2-(5-chloro-2-hydroxy-phenyl)-1,3-dithian-2-yl]-4-hydroxy-2,3-diisopropoxy-cyclobut-2-en-1-one Formula: C20H25ClO5S2 MolecularWeight: 444.9925

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C(C1=O)(C2(SCCCS2)C3=C(C=CC(=C3)Cl)O)O)OC(C)C

Isomeric SMILES

CC(C)OC1=C(C(C1=O)(C2(SCCCS2)C3=C(C=CC(=C3)Cl)O)O)OC(C)C

InChI

InChI=1S/C20H25ClO5S2/c1-11(2)25-16-17(23)19(24,18(16)26-12(3)4)20(27-8-5-9-28-20)14-10-13(21)6-7-15(14)22/h6-7,10-12,22,24H,5,8-9H2,1-4H3