3-cycloheptyl-2-(4-methylsulfonylphenyl)propanoic acid

Systemtic Name: 3-cycloheptyl-2-(4-methylsulfonylphenyl)propanoic acid Openeye Name: 3-cycloheptyl-2-(4-methylsulfonylphenyl)propanoic acid CAS Name: 3-cycloheptyl-2-(4-methylsulfonylphenyl)propanoic acid IUPAC Name: 3-cycloheptyl-2-(4-methylsulfonylphenyl)propanoic acid Traditional Name: 3-cycloheptyl-2-(4-mesylphenyl)propionic acid Formula: C17H24O4S MolecularWeight: 324.43506

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(CC2CCCCCC2)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(CC2CCCCCC2)C(=O)O

InChI

InChI=1S/C17H24O4S/c1-22(20,21)15-10-8-14(9-11-15)16(17(18)19)12-13-6-4-2-3-5-7-13/h8-11,13,16H,2-7,12H2,1H3,(H,18,19)