3-[(4-methylphenyl)sulfonyloxymethyl]-4-thiophen-3-yl-butanoic acid

Systemtic Name: 3-[(4-methylphenyl)sulfonyloxymethyl]-4-thiophen-3-yl-butanoic acid Openeye Name: 3-(p-tolylsulfonyloxymethyl)-4-(3-thienyl)butanoic acid CAS Name: 3-[(4-methylphenyl)sulfonyloxymethyl]-4-(3-thiophenyl)butanoic acid IUPAC Name: 3-[(4-methylphenyl)sulfonyloxymethyl]-4-thiophen-3-ylbutanoic acid Traditional Name: 3-(3-thenyl)-4-tosyloxy-butyric acid Formula: C16H18O5S2 MolecularWeight: 354.44112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(CC2=CSC=C2)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(CC2=CSC=C2)CC(=O)O

InChI

InChI=1S/C16H18O5S2/c1-12-2-4-15(5-3-12)23(19,20)21-10-14(9-16(17)18)8-13-6-7-22-11-13/h2-7,11,14H,8-10H2,1H3,(H,17,18)