2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-(oxolan-3-yl)propanoic acid

Systemtic Name: 2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-(oxolan-3-yl)propanoic acid Openeye Name: 2-(3-chloro-4-methylsulfonyl-phenyl)-3-tetrahydrofuran-3-yl-propanoic acid CAS Name: 2-(3-chloro-4-methylsulfonylphenyl)-3-(3-oxolanyl)propanoic acid IUPAC Name: 2-(3-chloro-4-methylsulfonylphenyl)-3-(oxolan-3-yl)propanoic acid Traditional Name: 2-(3-chloro-4-mesyl-phenyl)-3-tetrahydrofuran-3-yl-propionic acid Formula: C14H17ClO5S MolecularWeight: 332.79978

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCOC2)C(=O)O)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCOC2)C(=O)O)Cl

InChI

InChI=1S/C14H17ClO5S/c1-21(18,19)13-3-2-10(7-12(13)15)11(14(16)17)6-9-4-5-20-8-9/h2-3,7,9,11H,4-6,8H2,1H3,(H,16,17)