3-cyclohexyl-2-(4-methoxyphenyl)sulfonyl-propanoic acid

Systemtic Name: 3-cyclohexyl-2-(4-methoxyphenyl)sulfonyl-propanoic acid Openeye Name: 3-cyclohexyl-2-(4-methoxyphenyl)sulfonyl-propanoic acid CAS Name: 3-cyclohexyl-2-(4-methoxyphenyl)sulfonylpropanoic acid IUPAC Name: 3-cyclohexyl-2-(4-methoxyphenyl)sulfonylpropanoic acid Traditional Name: 3-cyclohexyl-2-(4-methoxyphenyl)sulfonyl-propionic acid Formula: C16H22O5S MolecularWeight: 326.40788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C(CC2CCCCC2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C(CC2CCCCC2)C(=O)O

InChI

InChI=1S/C16H22O5S/c1-21-13-7-9-14(10-8-13)22(19,20)15(16(17)18)11-12-5-3-2-4-6-12/h7-10,12,15H,2-6,11H2,1H3,(H,17,18)