2-[5-tert-butyl-2-[4-chloranyl-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-tert-butyl-2-[4-chloranyl-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-tert-butyl-2-[4-chloro-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]acetic acid CAS Name: 2-[5-tert-butyl-2-[4-chloro-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-tert-butyl-2-[4-chloro-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]acetic acid Traditional Name: 2-[5-tert-butyl-2-[4-chloro-3-(cyclohexylsulfamoyl)phenyl]-1H-indol-3-yl]acetic acid Formula: C26H31ClN2O4S MolecularWeight: 503.05334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)Cl)S(=O)(=O)NC4CCCCC4

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)Cl)S(=O)(=O)NC4CCCCC4

InChI

InChI=1S/C26H31ClN2O4S/c1-26(2,3)17-10-12-22-19(14-17)20(15-24(30)31)25(28-22)16-9-11-21(27)23(13-16)34(32,33)29-18-7-5-4-6-8-18/h9-14,18,28-29H,4-8,15H2,1-3H3,(H,30,31)