2-[(5-ethylthiophen-2-yl)methylsulfonyl]benzoate

Systemtic Name: 2-[(5-ethylthiophen-2-yl)methylsulfonyl]benzoate Openeye Name: 2-[(5-ethyl-2-thienyl)methylsulfonyl]benzoate CAS Name: 2-[(5-ethyl-2-thiophenyl)methylsulfonyl]benzoate IUPAC Name: 2-[(5-ethylthiophen-2-yl)methylsulfonyl]benzoate Traditional Name: 2-[(5-ethyl-2-thienyl)methylsulfonyl]benzoate Formula: C14H13O4S2- MolecularWeight: 309.38062

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)CS(=O)(=O)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CCC1=CC=C(S1)CS(=O)(=O)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C14H14O4S2/c1-2-10-7-8-11(19-10)9-20(17,18)13-6-4-3-5-12(13)14(15)16/h3-8H,2,9H2,1H3,(H,15,16)/p-1