4-methyl-2-(1-thiophen-2-ylethyl)benzenesulfonic acid

Systemtic Name: 4-methyl-2-(1-thiophen-2-ylethyl)benzenesulfonic acid Openeye Name: 4-methyl-2-[1-(2-thienyl)ethyl]benzenesulfonic acid CAS Name: 4-methyl-2-(1-thiophen-2-ylethyl)benzenesulfonic acid IUPAC Name: 4-methyl-2-(1-thiophen-2-ylethyl)benzenesulfonic acid Traditional Name: 4-methyl-2-[1-(2-thienyl)ethyl]besylic acid Formula: C13H14O3S2 MolecularWeight: 282.37846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)O)C(C)C2=CC=CS2

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)O)C(C)C2=CC=CS2

InChI

InChI=1S/C13H14O3S2/c1-9-5-6-13(18(14,15)16)11(8-9)10(2)12-4-3-7-17-12/h3-8,10H,1-2H3,(H,14,15,16)