2-[3-chloranyl-5-(2-cyano-4-ethylsulfonyl-phenoxy)phenyl]ethanoic acid

Systemtic Name: 2-[3-chloranyl-5-(2-cyano-4-ethylsulfonyl-phenoxy)phenyl]ethanoic acid Openeye Name: 2-[3-chloro-5-(2-cyano-4-ethylsulfonyl-phenoxy)phenyl]acetic acid CAS Name: 2-[3-chloro-5-(2-cyano-4-ethylsulfonylphenoxy)phenyl]acetic acid IUPAC Name: 2-[3-chloro-5-(2-cyano-4-ethylsulfonylphenoxy)phenyl]acetic acid Traditional Name: 2-[3-chloro-5-(2-cyano-4-esyl-phenoxy)phenyl]acetic acid Formula: C17H14ClNO5S MolecularWeight: 379.81476

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)OC2=CC(=CC(=C2)CC(=O)O)Cl)C#N

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)OC2=CC(=CC(=C2)CC(=O)O)Cl)C#N

InChI

InChI=1S/C17H14ClNO5S/c1-2-25(22,23)15-3-4-16(12(8-15)10-19)24-14-6-11(7-17(20)21)5-13(18)9-14/h3-6,8-9H,2,7H2,1H3,(H,20,21)