7-(4-chlorophenyl)-2-ethylsulfonyl-heptanoic acid

Systemtic Name: 7-(4-chlorophenyl)-2-ethylsulfonyl-heptanoic acid Openeye Name: 7-(4-chlorophenyl)-2-ethylsulfonyl-heptanoic acid CAS Name: 7-(4-chlorophenyl)-2-ethylsulfonylheptanoic acid IUPAC Name: 7-(4-chlorophenyl)-2-ethylsulfonylheptanoic acid Traditional Name: 7-(4-chlorophenyl)-2-esyl-enanthic acid Formula: C15H21ClO4S MolecularWeight: 332.84284

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C(CCCCCC1=CC=C(C=C1)Cl)C(=O)O

Isomeric SMILES

CCS(=O)(=O)C(CCCCCC1=CC=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C15H21ClO4S/c1-2-21(19,20)14(15(17)18)7-5-3-4-6-12-8-10-13(16)11-9-12/h8-11,14H,2-7H2,1H3,(H,17,18)