(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate CAS Name: 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate Traditional Name: 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C26H28N2O5S/c1-26(2,3)21-13-15-22(16-14-21)34(31,32)28-17-18-9-11-20(12-10-18)25(30)33-23(24(27)29)19-7-5-4-6-8-19/h4-16,23,28H,17H2,1-3H3,(H2,27,29)