2-cyclohexyl-2-phenylsulfanyl-ethanoic acid

Systemtic Name: 2-cyclohexyl-2-phenylsulfanyl-ethanoic acid Openeye Name: 2-cyclohexyl-2-phenylsulfanyl-acetic acid CAS Name: 2-cyclohexyl-2-(phenylthio)acetic acid IUPAC Name: 2-cyclohexyl-2-phenylsulfanylacetic acid Traditional Name: 2-cyclohexyl-2-(phenylthio)acetic acid Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(=O)O)SC2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)C(C(=O)O)SC2=CC=CC=C2

InChI

InChI=1S/C14H18O2S/c15-14(16)13(11-7-3-1-4-8-11)17-12-9-5-2-6-10-12/h2,5-6,9-11,13H,1,3-4,7-8H2,(H,15,16)