3-[1-(5-ethanoylthiophen-2-yl)ethyl]-4-methyl-benzenesulfonate

Systemtic Name: 3-[1-(5-ethanoylthiophen-2-yl)ethyl]-4-methyl-benzenesulfonate Openeye Name: 3-[1-(5-acetyl-2-thienyl)ethyl]-4-methyl-benzenesulfonate CAS Name: 3-[1-(5-acetyl-2-thiophenyl)ethyl]-4-methylbenzenesulfonate IUPAC Name: 3-[1-(5-acetylthiophen-2-yl)ethyl]-4-methylbenzenesulfonate Traditional Name: 3-[1-(5-acetyl-2-thienyl)ethyl]-4-methyl-besylate Formula: C15H15O4S2- MolecularWeight: 323.4072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)[O-])C(C)C2=CC=C(S2)C(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)[O-])C(C)C2=CC=C(S2)C(=O)C

InChI

InChI=1S/C15H16O4S2/c1-9-4-5-12(21(17,18)19)8-13(9)10(2)14-6-7-15(20-14)11(3)16/h4-8,10H,1-3H3,(H,17,18,19)/p-1