3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoate

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoate Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoate CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylthio)propanoate IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanoate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylthio)propionate Formula: C11H11O4S- MolecularWeight: 239.26764

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCCC(=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCCC(=O)[O-]

InChI

InChI=1S/C11H12O4S/c12-11(13)3-6-16-8-1-2-9-10(7-8)15-5-4-14-9/h1-2,7H,3-6H2,(H,12,13)/p-1