3-[4-chloranyl-2-(4-pyridin-2-ylsulfonylphenyl)phenyl]propanoic acid

Systemtic Name: 3-[4-chloranyl-2-(4-pyridin-2-ylsulfonylphenyl)phenyl]propanoic acid Openeye Name: 3-[4-chloro-2-[4-(2-pyridylsulfonyl)phenyl]phenyl]propanoic acid CAS Name: 3-[4-chloro-2-[4-(2-pyridinylsulfonyl)phenyl]phenyl]propanoic acid IUPAC Name: 3-[4-chloro-2-(4-pyridin-2-ylsulfonylphenyl)phenyl]propanoic acid Traditional Name: 3-[4-chloro-2-[4-(2-pyridylsulfonyl)phenyl]phenyl]propionic acid Formula: C20H16ClNO4S MolecularWeight: 401.86334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)S(=O)(=O)C2=CC=C(C=C2)C3=C(C=CC(=C3)Cl)CCC(=O)O

Isomeric SMILES

C1=CC=NC(=C1)S(=O)(=O)C2=CC=C(C=C2)C3=C(C=CC(=C3)Cl)CCC(=O)O

InChI

InChI=1S/C20H16ClNO4S/c21-16-8-4-14(7-11-20(23)24)18(13-16)15-5-9-17(10-6-15)27(25,26)19-3-1-2-12-22-19/h1-6,8-10,12-13H,7,11H2,(H,23,24)