2-[4-(cyclohexylmethylsulfonyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(cyclohexylmethylsulfonyl)phenyl]ethanoic acid Openeye Name: 2-[4-(cyclohexylmethylsulfonyl)phenyl]acetic acid CAS Name: 2-[4-(cyclohexylmethylsulfonyl)phenyl]acetic acid IUPAC Name: 2-[4-(cyclohexylmethylsulfonyl)phenyl]acetic acid Traditional Name: 2-[4-(cyclohexylmethylsulfonyl)phenyl]acetic acid Formula: C15H20O4S MolecularWeight: 296.3819

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CS(=O)(=O)C2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

C1CCC(CC1)CS(=O)(=O)C2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C15H20O4S/c16-15(17)10-12-6-8-14(9-7-12)20(18,19)11-13-4-2-1-3-5-13/h6-9,13H,1-5,10-11H2,(H,16,17)