(phenylmethyl) 3-[2-[4-(2-methylpropyl)phenyl]propanoylsulfamoyl]propanoate

Systemtic Name: (phenylmethyl) 3-[2-[4-(2-methylpropyl)phenyl]propanoylsulfamoyl]propanoate Openeye Name: benzyl 3-[2-(4-isobutylphenyl)propanoylsulfamoyl]propanoate CAS Name: 3-[[2-[4-(2-methylpropyl)phenyl]-1-oxopropyl]sulfamoyl]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[2-[4-(2-methylpropyl)phenyl]propanoylsulfamoyl]propanoate Traditional Name: 3-[2-(4-isobutylphenyl)propanoylsulfamoyl]propionic acid benzyl ester Formula: C23H29NO5S MolecularWeight: 431.54506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)C(=O)NS(=O)(=O)CCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)C(=O)NS(=O)(=O)CCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H29NO5S/c1-17(2)15-19-9-11-21(12-10-19)18(3)23(26)24-30(27,28)14-13-22(25)29-16-20-7-5-4-6-8-20/h4-12,17-18H,13-16H2,1-3H3,(H,24,26)