2-[4-[2-(4-chloranylphenoxy)phenyl]thian-2-yl]ethanoic acid

Systemtic Name: 2-[4-[2-(4-chloranylphenoxy)phenyl]thian-2-yl]ethanoic acid Openeye Name: 2-[4-[2-(4-chlorophenoxy)phenyl]tetrahydrothiopyran-2-yl]acetic acid CAS Name: 2-[4-[2-(4-chlorophenoxy)phenyl]-2-thianyl]acetic acid IUPAC Name: 2-[4-[2-(4-chlorophenoxy)phenyl]thian-2-yl]acetic acid Traditional Name: 2-[4-[2-(4-chlorophenoxy)phenyl]tetrahydrothiopyran-2-yl]acetic acid Formula: C19H19ClO3S MolecularWeight: 362.87036

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(CC1C2=CC=CC=C2OC3=CC=C(C=C3)Cl)CC(=O)O

Isomeric SMILES

C1CSC(CC1C2=CC=CC=C2OC3=CC=C(C=C3)Cl)CC(=O)O

InChI

InChI=1S/C19H19ClO3S/c20-14-5-7-15(8-6-14)23-18-4-2-1-3-17(18)13-9-10-24-16(11-13)12-19(21)22/h1-8,13,16H,9-12H2,(H,21,22)