3-[2-(4-chlorophenyl)ethoxy]-2-(4-methylphenyl)sulfonyl-propanoic acid

Systemtic Name: 3-[2-(4-chlorophenyl)ethoxy]-2-(4-methylphenyl)sulfonyl-propanoic acid Openeye Name: 3-[2-(4-chlorophenyl)ethoxy]-2-(p-tolylsulfonyl)propanoic acid CAS Name: 3-[2-(4-chlorophenyl)ethoxy]-2-(4-methylphenyl)sulfonylpropanoic acid IUPAC Name: 3-[2-(4-chlorophenyl)ethoxy]-2-(4-methylphenyl)sulfonylpropanoic acid Traditional Name: 3-[2-(4-chlorophenyl)ethoxy]-2-tosyl-propionic acid Formula: C18H19ClO5S MolecularWeight: 382.85846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(COCCC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(COCCC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C18H19ClO5S/c1-13-2-8-16(9-3-13)25(22,23)17(18(20)21)12-24-11-10-14-4-6-15(19)7-5-14/h2-9,17H,10-12H2,1H3,(H,20,21)