butan-2-yl 2-(5-ethanoylthiophen-2-yl)-4-methyl-benzenesulfonate

Systemtic Name: butan-2-yl 2-(5-ethanoylthiophen-2-yl)-4-methyl-benzenesulfonate Openeye Name: sec-butyl 2-(5-acetyl-2-thienyl)-4-methyl-benzenesulfonate CAS Name: 2-(5-acetyl-2-thiophenyl)-4-methylbenzenesulfonic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-(5-acetylthiophen-2-yl)-4-methylbenzenesulfonate Traditional Name: 2-(5-acetyl-2-thienyl)-4-methyl-benzenesulfonic acid sec-butyl ester Formula: C17H20O4S2 MolecularWeight: 352.4683

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OS(=O)(=O)C1=C(C=C(C=C1)C)C2=CC=C(S2)C(=O)C

Isomeric SMILES

CCC(C)OS(=O)(=O)C1=C(C=C(C=C1)C)C2=CC=C(S2)C(=O)C

InChI

InChI=1S/C17H20O4S2/c1-5-12(3)21-23(19,20)17-9-6-11(2)10-14(17)16-8-7-15(22-16)13(4)18/h6-10,12H,5H2,1-4H3