butyl 4-[[3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoyl]amino]benzoate

Systemtic Name: butyl 4-[[3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoyl]amino]benzoate Openeye Name: butyl 4-[[3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoyl]amino]benzoate CAS Name: 4-[[1-oxo-3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[3-phenyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoyl]amino]benzoate Traditional Name: 4-[[2-(mesitylsulfonylamino)-3-phenyl-propanoyl]amino]benzoic acid butyl ester Formula: C29H34N2O5S MolecularWeight: 522.65566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=C(C=C(C=C3C)C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C29H34N2O5S/c1-5-6-16-36-29(33)24-12-14-25(15-13-24)30-28(32)26(19-23-10-8-7-9-11-23)31-37(34,35)27-21(3)17-20(2)18-22(27)4/h7-15,17-18,26,31H,5-6,16,19H2,1-4H3,(H,30,32)