3-[5-chloranyl-1-[3-(4-fluorophenyl)phenyl]sulfonyl-indol-3-yl]propanoic acid

Systemtic Name: 3-[5-chloranyl-1-[3-(4-fluorophenyl)phenyl]sulfonyl-indol-3-yl]propanoic acid Openeye Name: 3-[5-chloro-1-[3-(4-fluorophenyl)phenyl]sulfonyl-indol-3-yl]propanoic acid CAS Name: 3-[5-chloro-1-[3-(4-fluorophenyl)phenyl]sulfonyl-3-indolyl]propanoic acid IUPAC Name: 3-[5-chloro-1-[3-(4-fluorophenyl)phenyl]sulfonylindol-3-yl]propanoic acid Traditional Name: 3-[5-chloro-1-[3-(4-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)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Cl)CCC(=O)O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Cl)CCC(=O)O)C4=CC=C(C=C4)F

InChI

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