3-[4-[[1-(4-tert-butylphenyl)-2-methyl-propyl]sulfamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[[1-(4-tert-butylphenyl)-2-methyl-propyl]sulfamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[[1-(4-tert-butylphenyl)-2-methyl-propyl]sulfamoyl]phenyl]propanoic acid CAS Name: 3-[4-[[1-(4-tert-butylphenyl)-2-methylpropyl]sulfamoyl]phenyl]propanoic acid IUPAC Name: 3-[4-[[1-(4-tert-butylphenyl)-2-methylpropyl]sulfamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[[1-(4-tert-butylphenyl)-2-methyl-propyl]sulfamoyl]phenyl]propionic acid Formula: C23H31NO4S MolecularWeight: 417.56154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)C(C)(C)C)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)C(C)(C)C)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)O

InChI

InChI=1S/C23H31NO4S/c1-16(2)22(18-9-11-19(12-10-18)23(3,4)5)24-29(27,28)20-13-6-17(7-14-20)8-15-21(25)26/h6-7,9-14,16,22,24H,8,15H2,1-5H3,(H,25,26)