2-[3-[2-[(E)-4-naphthalen-2-yl-3-oxidanyl-but-1-enyl]-5-oxidanylidene-cyclopentyl]sulfanylpropylsulfanyl]ethanoic acid

Systemtic Name: 2-[3-[2-[(E)-4-naphthalen-2-yl-3-oxidanyl-but-1-enyl]-5-oxidanylidene-cyclopentyl]sulfanylpropylsulfanyl]ethanoic acid Openeye Name: 2-[3-[2-[(E)-3-hydroxy-4-(2-naphthyl)but-1-enyl]-5-oxo-cyclopentyl]sulfanylpropylsulfanyl]acetic acid CAS Name: 2-[3-[[2-[(E)-3-hydroxy-4-(2-naphthalenyl)but-1-enyl]-5-oxocyclopentyl]thio]propylthio]acetic acid IUPAC Name: 2-[3-[2-[(E)-3-hydroxy-4-naphthalen-2-ylbut-1-enyl]-5-oxocyclopentyl]sulfanylpropylsulfanyl]acetic acid Traditional Name: 2-[3-[[2-[(E)-3-hydroxy-4-(2-naphthyl)but-1-enyl]-5-keto-cyclopentyl]thio]propylthio]acetic acid Formula: C24H28O4S2 MolecularWeight: 444.60672

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C1C=CC(CC2=CC3=CC=CC=C3C=C2)O)SCCCSCC(=O)O

Isomeric SMILES

C1CC(=O)C(C1/C=C/C(CC2=CC3=CC=CC=C3C=C2)O)SCCCSCC(=O)O

InChI

InChI=1S/C24H28O4S2/c25-21(15-17-6-7-18-4-1-2-5-20(18)14-17)10-8-19-9-11-22(26)24(19)30-13-3-12-29-16-23(27)28/h1-2,4-8,10,14,19,21,24-25H,3,9,11-13,15-16H2,(H,27,28)/b10-8+