2-[4-(oxolan-2-ylmethylsulfonyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(oxolan-2-ylmethylsulfonyl)phenyl]ethanoic acid Openeye Name: 2-[4-(tetrahydrofuran-2-ylmethylsulfonyl)phenyl]acetic acid CAS Name: 2-[4-(2-oxolanylmethylsulfonyl)phenyl]acetic acid IUPAC Name: 2-[4-(oxolan-2-ylmethylsulfonyl)phenyl]acetic acid Traditional Name: 2-[4-(tetrahydrofurfurylsulfonyl)phenyl]acetic acid Formula: C13H16O5S MolecularWeight: 284.32814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CS(=O)(=O)C2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

C1CC(OC1)CS(=O)(=O)C2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C13H16O5S/c14-13(15)8-10-3-5-12(6-4-10)19(16,17)9-11-2-1-7-18-11/h3-6,11H,1-2,7-9H2,(H,14,15)