(4-cyanophenyl)methyl 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate

Systemtic Name: (4-cyanophenyl)methyl 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate Openeye Name: (4-cyanophenyl)methyl 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate CAS Name: 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoate Traditional Name: 4-[[(4-tert-butylphenyl)sulfonylamino]methyl]benzoic acid (4-cyanobenzyl) ester Formula: C26H26N2O4S MolecularWeight: 462.56064

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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)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H26N2O4S/c1-26(2,3)23-12-14-24(15-13-23)33(30,31)28-17-20-8-10-22(11-9-20)25(29)32-18-21-6-4-19(16-27)5-7-21/h4-15,28H,17-18H2,1-3H3