2-(6,7-dihydro-5H-cyclopenta[f][1,3]benzodioxol-7-ylsulfanyl)ethanoic acid

Systemtic Name: 2-(6,7-dihydro-5H-cyclopenta[f][1,3]benzodioxol-7-ylsulfanyl)ethanoic acid Openeye Name: 2-(6,7-dihydro-5H-cyclopenta[f][1,3]benzodioxol-7-ylsulfanyl)acetic acid CAS Name: 2-(6,7-dihydro-5H-cyclopenta[f][1,3]benzodioxol-7-ylthio)acetic acid IUPAC Name: 2-(6,7-dihydro-5H-cyclopenta[f][1,3]benzodioxol-7-ylsulfanyl)acetic acid Traditional Name: 2-(6,7-dihydro-5H-cyclopenta[f][1,3]benzodioxol-7-ylthio)acetic acid Formula: C12H12O4S MolecularWeight: 252.28628

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC3=C(C=C2C1SCC(=O)O)OCO3

Isomeric SMILES

C1CC2=CC3=C(C=C2C1SCC(=O)O)OCO3

InChI

InChI=1S/C12H12O4S/c13-12(14)5-17-11-2-1-7-3-9-10(4-8(7)11)16-6-15-9/h3-4,11H,1-2,5-6H2,(H,13,14)