2-[2-[4-chloranyl-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]propanoic acid

Systemtic Name: 2-[2-[4-chloranyl-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]propanoic acid Openeye Name: 2-[2-[4-chloro-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]propanoic acid CAS Name: 2-[2-[4-chloro-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]propanoic acid IUPAC Name: 2-[2-[4-chloro-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]propanoic acid Traditional Name: 2-[2-[4-chloro-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]propionic acid Formula: C23H25ClN2O4S MolecularWeight: 460.9736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(NC2=CC=CC=C21)C3=CC(=C(C=C3)Cl)S(=O)(=O)NC4CCCCC4)C(=O)O

Isomeric SMILES

CC(C1=C(NC2=CC=CC=C21)C3=CC(=C(C=C3)Cl)S(=O)(=O)NC4CCCCC4)C(=O)O

InChI

InChI=1S/C23H25ClN2O4S/c1-14(23(27)28)21-17-9-5-6-10-19(17)25-22(21)15-11-12-18(24)20(13-15)31(29,30)26-16-7-3-2-4-8-16/h5-6,9-14,16,25-26H,2-4,7-8H2,1H3,(H,27,28)