3-[3-(3-cyclopentyl-2-oxidanyl-phenyl)-2-oxidanyl-propyl]sulfanylpropanoic acid

Systemtic Name: 3-[3-(3-cyclopentyl-2-oxidanyl-phenyl)-2-oxidanyl-propyl]sulfanylpropanoic acid Openeye Name: 3-[3-(3-cyclopentyl-2-hydroxy-phenyl)-2-hydroxy-propyl]sulfanylpropanoic acid CAS Name: 3-[[3-(3-cyclopentyl-2-hydroxyphenyl)-2-hydroxypropyl]thio]propanoic acid IUPAC Name: 3-[3-(3-cyclopentyl-2-hydroxyphenyl)-2-hydroxypropyl]sulfanylpropanoic acid Traditional Name: 3-[[3-(3-cyclopentyl-2-hydroxy-phenyl)-2-hydroxy-propyl]thio]propionic acid Formula: C17H24O4S MolecularWeight: 324.43506

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=C(C(=CC=C2)CC(CSCCC(=O)O)O)O

Isomeric SMILES

C1CCC(C1)C2=C(C(=CC=C2)CC(CSCCC(=O)O)O)O

InChI

InChI=1S/C17H24O4S/c18-14(11-22-9-8-16(19)20)10-13-6-3-7-15(17(13)21)12-4-1-2-5-12/h3,6-7,12,14,18,21H,1-2,4-5,8-11H2,(H,19,20)