2-cyclohexyl-2-(2-sulfophenyl)ethanoic acid

Systemtic Name: 2-cyclohexyl-2-(2-sulfophenyl)ethanoic acid Openeye Name: 2-cyclohexyl-2-(2-sulfophenyl)acetic acid CAS Name: 2-cyclohexyl-2-(2-sulfophenyl)acetic acid IUPAC Name: 2-cyclohexyl-2-(2-sulfophenyl)acetic acid Traditional Name: 2-cyclohexyl-2-(2-sulfophenyl)acetic acid Formula: C14H18O5S MolecularWeight: 298.35472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2=CC=CC=C2S(=O)(=O)O)C(=O)O

Isomeric SMILES

C1CCC(CC1)C(C2=CC=CC=C2S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C14H18O5S/c15-14(16)13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)20(17,18)19/h4-5,8-10,13H,1-3,6-7H2,(H,15,16)(H,17,18,19)