2-(4-chlorophenyl)-3-ethoxy-2-(4-methylphenyl)sulfonyl-butanoic acid

Systemtic Name: 2-(4-chlorophenyl)-3-ethoxy-2-(4-methylphenyl)sulfonyl-butanoic acid Openeye Name: 2-(4-chlorophenyl)-3-ethoxy-2-(p-tolylsulfonyl)butanoic acid CAS Name: 2-(4-chlorophenyl)-3-ethoxy-2-(4-methylphenyl)sulfonylbutanoic acid IUPAC Name: 2-(4-chlorophenyl)-3-ethoxy-2-(4-methylphenyl)sulfonylbutanoic acid Traditional Name: 2-(4-chlorophenyl)-3-ethoxy-2-tosyl-butyric acid Formula: C19H21ClO5S MolecularWeight: 396.88504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)C(C1=CC=C(C=C1)Cl)(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(C)C(C1=CC=C(C=C1)Cl)(C(=O)O)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C19H21ClO5S/c1-4-25-14(3)19(18(21)22,15-7-9-16(20)10-8-15)26(23,24)17-11-5-13(2)6-12-17/h5-12,14H,4H2,1-3H3,(H,21,22)