3-[(5-ethylthiophen-2-yl)methylsulfonyl]propanoate

Systemtic Name: 3-[(5-ethylthiophen-2-yl)methylsulfonyl]propanoate Openeye Name: 3-[(5-ethyl-2-thienyl)methylsulfonyl]propanoate CAS Name: 3-[(5-ethyl-2-thiophenyl)methylsulfonyl]propanoate IUPAC Name: 3-[(5-ethylthiophen-2-yl)methylsulfonyl]propanoate Traditional Name: 3-[(5-ethyl-2-thienyl)methylsulfonyl]propionate Formula: C10H13O4S2- MolecularWeight: 261.33782

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)CS(=O)(=O)CCC(=O)[O-]

Isomeric SMILES

CCC1=CC=C(S1)CS(=O)(=O)CCC(=O)[O-]

InChI

InChI=1S/C10H14O4S2/c1-2-8-3-4-9(15-8)7-16(13,14)6-5-10(11)12/h3-4H,2,5-7H2,1H3,(H,11,12)/p-1