3-[5-chloranyl-1-[3-(3-fluorophenyl)phenyl]sulfonyl-indol-3-yl]propanoic acid

Systemtic Name: 3-[5-chloranyl-1-[3-(3-fluorophenyl)phenyl]sulfonyl-indol-3-yl]propanoic acid Openeye Name: 3-[5-chloro-1-[3-(3-fluorophenyl)phenyl]sulfonyl-indol-3-yl]propanoic acid CAS Name: 3-[5-chloro-1-[3-(3-fluorophenyl)phenyl]sulfonyl-3-indolyl]propanoic acid IUPAC Name: 3-[5-chloro-1-[3-(3-fluorophenyl)phenyl]sulfonylindol-3-yl]propanoic acid Traditional Name: 3-[5-chloro-1-[3-(3-fluorophenyl)phenyl]sulfonyl-indol-3-yl]propionic acid Formula: C23H17ClFNO4S MolecularWeight: 457.901783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C2=CC(=CC=C2)S(=O)(=O)N3C=C(C4=C3C=CC(=C4)Cl)CCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)F)C2=CC(=CC=C2)S(=O)(=O)N3C=C(C4=C3C=CC(=C4)Cl)CCC(=O)O

InChI

InChI=1S/C23H17ClFNO4S/c24-18-8-9-22-21(13-18)17(7-10-23(27)28)14-26(22)31(29,30)20-6-2-4-16(12-20)15-3-1-5-19(25)11-15/h1-6,8-9,11-14H,7,10H2,(H,27,28)