2-[1-(4-phenoxyphenyl)sulfanylcyclohexyl]ethanoic acid

Systemtic Name: 2-[1-(4-phenoxyphenyl)sulfanylcyclohexyl]ethanoic acid Openeye Name: 2-[1-(4-phenoxyphenyl)sulfanylcyclohexyl]acetic acid CAS Name: 2-[1-[(4-phenoxyphenyl)thio]cyclohexyl]acetic acid IUPAC Name: 2-[1-(4-phenoxyphenyl)sulfanylcyclohexyl]acetic acid Traditional Name: 2-[1-[(4-phenoxyphenyl)thio]cyclohexyl]acetic acid Formula: C20H22O3S MolecularWeight: 342.45188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)O)SC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)(CC(=O)O)SC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H22O3S/c21-19(22)15-20(13-5-2-6-14-20)24-18-11-9-17(10-12-18)23-16-7-3-1-4-8-16/h1,3-4,7-12H,2,5-6,13-15H2,(H,21,22)